LMucko/crystallography-open-database huggingface dataset:
Aqueous Polymerization of Styrene Promoted by Water-Soluble Robust Ruthenium Hydride Complexes
Ogo, Seiji; Uehara, Keiji; Abura, Tsutomu; Watanabe, Yoshihito; Fukuzumi, Shunichi; Organometallics 23 (2004) 3047–3052; doi:10.1021/om034335b

data_4062614
_publ_section_title
;
Aqueous Polymerization of Styrene Promoted by Water-Soluble Robust 
Ruthenium Hydride Complexes
;
_journal_issue                   12
_journal_name_full               Organometallics
_journal_page_first              3047
_journal_page_last               3052
_journal_paper_doi               10.1021/om034335b
_journal_volume                  23
_journal_year                    2004
_chemical_formula_sum            'C23 H27 F3 N2 O3 Ru S'
_chemical_formula_weight         569.60
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 107.313(6)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   13.371(6)
_cell_length_b                   13.509(6)
_cell_length_c                   13.777(7)
_cell_measurement_temperature    223.2
_cell_volume                     2375(1)
_exptl_crystal_density_diffrn    1.592
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_original_formula_sum        'C23 H27 F3 N2 O3 S Ru '
_cod_database_code               4062614
Alkyl Transfer Reactivity in the First Octahedral Isocyanide Complex of Nickel(II)
Enmanuel Boillos; Daniel Miguel; Organometallics  (2004) –; doi:10.1021/om0343364

data_4062615
_publ_section_title
;
Alkyl Transfer Reactivity in the First
 Octahedral Isocyanide Complex of Nickel(II)
;
_journal_name_full               Organometallics
_journal_paper_doi               10.1021/om0343364
_journal_year                    2004
_chemical_formula_sum            'C26 H38 N2 Ni O4 P2 S4'
_chemical_formula_weight         691.47
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                101.227(4)
_cell_angle_beta                 90.509(5)
_cell_angle_gamma                96.954(4)
_cell_formula_units_Z            2
_cell_length_a                   10.911(3)
_cell_length_b                   10.932(3)
_cell_length_c                   14.640(4)
_cell_measurement_temperature    293(2)
_cell_volume                     1699.1(8)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.352
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_database_code               4062615
Alkyl Transfer Reactivity in the First Octahedral Isocyanide Complex of Nickel(II)
Enmanuel Boillos; Daniel Miguel; Organometallics  (2004) –; doi:10.1021/om0343364

data_4062616
_publ_section_title
;
Alkyl Transfer Reactivity in the First
 Octahedral Isocyanide Complex of Nickel(II)
;
_journal_name_full               Organometallics
_journal_paper_doi               10.1021/om0343364
_journal_year                    2004
_chemical_formula_sum            'C30 H49 Cl2 N Ni O2 P2 S2'
_chemical_formula_weight         711.37
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.104(2)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   16.5217(12)
_cell_length_b                   13.9033(10)
_cell_length_c                   15.3086(11)
_cell_measurement_temperature    293(2)
_cell_volume                     3516.5(4)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.344
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               4062616
Alkyl Transfer Reactivity in the First Octahedral Isocyanide Complex of Nickel(II)
Enmanuel Boillos; Daniel Miguel; Organometallics  (2004) –; doi:10.1021/om0343364

data_4062617
_publ_section_title
;
Alkyl Transfer Reactivity in the First
 Octahedral Isocyanide Complex of Nickel(II)
;
_journal_name_full               Organometallics
_journal_paper_doi               10.1021/om0343364
_journal_year                    2004
_chemical_formula_sum            'C20 H23 N2 Ni O2 P S2'
_chemical_formula_weight         477.20
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 102.738(6)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   15.406(5)
_cell_length_b                   13.201(4)
_cell_length_c                   22.338(7)
_cell_measurement_temperature    293(2)
_cell_volume                     4431(2)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.431
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_database_code               4062617
Alkyl Transfer Reactivity in the First Octahedral Isocyanide Complex of Nickel(II)
Enmanuel Boillos; Daniel Miguel; Organometallics  (2004) –; doi:10.1021/om0343364

data_4062618
_publ_section_title
;
Alkyl Transfer Reactivity in the First
 Octahedral Isocyanide Complex of Nickel(II)
;
_journal_name_full               Organometallics
_journal_paper_doi               10.1021/om0343364
_journal_year                    2004
_chemical_formula_sum            'C34 H44 N4 Ni O4 P2 S4'
_chemical_formula_weight         821.62
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                98.199(9)
_cell_angle_beta                 109.124(10)
_cell_angle_gamma                110.843(9)
_cell_formula_units_Z            2
_cell_length_a                   11.657(6)
_cell_length_b                   13.101(7)
_cell_length_c                   15.337(8)
_cell_measurement_temperature    293(2)
_cell_volume                     1977.2(18)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.380
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_database_code               4062618
β-Diketiminato Scandium Chemistry: Synthesis, Characterization, and Thermal Behavior of Primary Amido Alkyl Derivatives
Knight, L.; Piers, W. E.; Fleurat-Lessard, P.; Parvez, M.; McDonald, R.; Organometallics 23 (2004) 2087–2094; doi:10.1021/om034345c

data_4062619
_publ_section_title
;
\b-Diketiminato Scandium Chemistry: Synthesis, Characterization, and
Thermal Behavior of Primary Amido Alkyl Derivatives
;
_journal_name_full               Organometallics
_journal_page_first              2087
_journal_page_last               2094
_journal_paper_doi               10.1021/om034345c
_journal_volume                  23
_journal_year                    2004
_chemical_formula_sum            'C39 H63 Cl N3 Sc'
_chemical_formula_weight         654.33
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 105.0938(19)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   18.3145(15)
_cell_length_b                   17.6376(15)
_cell_length_c                   12.6483(11)
_cell_measurement_temperature    193(2)
_cell_volume                     3944.7(6)
_diffrn_ambient_temperature      193(2)
_exptl_crystal_density_diffrn    1.102
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               4062619
β-Diketiminato Scandium Chemistry: Synthesis, Characterization, and Thermal Behavior of Primary Amido Alkyl Derivatives
Knight, L.; Piers, W. E.; Fleurat-Lessard, P.; Parvez, M.; McDonald, R.; Organometallics 23 (2004) 2087–2094; doi:10.1021/om034345c

data_4062620
_publ_section_title
;
\b-Diketiminato Scandium Chemistry: Synthesis, Characterization, and
Thermal Behavior of Primary Amido Alkyl Derivatives
;
_journal_name_full               Organometallics
_journal_page_first              2087
_journal_page_last               2094
_journal_paper_doi               10.1021/om034345c
_journal_volume                  23
_journal_year                    2004
_chemical_formula_sum            'C50 H78 Cl N3 Sc'
_chemical_formula_weight         801.56
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                77.8167(9)
_cell_angle_beta                 73.7643(9)
_cell_angle_gamma                65.6747(9)
_cell_formula_units_Z            2
_cell_length_a                   10.9568(5)
_cell_length_b                   12.9352(6)
_cell_length_c                   19.6028(9)
_cell_measurement_temperature    193(2)
_cell_volume                     2416.02(19)
_diffrn_ambient_temperature      193(2)
_exptl_crystal_density_diffrn    1.102
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_database_code               4062620
β-Diketiminato Scandium Chemistry: Synthesis, Characterization, and Thermal Behavior of Primary Amido Alkyl Derivatives
Knight, L.; Piers, W. E.; Fleurat-Lessard, P.; Parvez, M.; McDonald, R.; Organometallics 23 (2004) 2087–2094; doi:10.1021/om034345c

data_4062621
_publ_section_title
;
\b-Diketiminato Scandium Chemistry: Synthesis, Characterization, and
Thermal Behavior of Primary Amido Alkyl Derivatives
;
_journal_name_full               Organometallics
_journal_page_first              2087
_journal_page_last               2094
_journal_paper_doi               10.1021/om034345c
_journal_volume                  23
_journal_year                    2004
_chemical_formula_sum            'C40 H66 N3 Sc'
_chemical_formula_weight         633.92
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                88.2825(14)
_cell_angle_beta                 89.3523(15)
_cell_angle_gamma                65.4512(15)
_cell_formula_units_Z            2
_cell_length_a                   11.2559(8)
_cell_length_b                   12.4490(9)
_cell_length_c                   15.4106(11)
_cell_measurement_temperature    193(2)
_cell_volume                     1963.3(2)
_diffrn_ambient_temperature      193(2)
_exptl_crystal_density_diffrn    1.072
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_database_code               4062621
β-Diketiminato Scandium Chemistry: Synthesis, Characterization, and Thermal Behavior of Primary Amido Alkyl Derivatives
Knight, L.; Piers, W. E.; Fleurat-Lessard, P.; Parvez, M.; McDonald, R.; Organometallics 23 (2004) 2087–2094; doi:10.1021/om034345c

data_4062622
_publ_section_title
;
\b-Diketiminato Scandium Chemistry: Synthesis, Characterization, and
Thermal Behavior of Primary Amido Alkyl Derivatives
;
_journal_name_full               Organometallics
_journal_page_first              2087
_journal_page_last               2094
_journal_paper_doi               10.1021/om034345c
_journal_volume                  23
_journal_year                    2004
_chemical_formula_sum            'C48 H74 N3 Sc'
_chemical_formula_weight         738.06
_space_group_IT_number           19
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  'P 2ac 2ab'
_symmetry_space_group_name_H-M   'P 21 21 21'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   13.5396(2)
_cell_length_b                   18.1218(2)
_cell_length_c                   18.5560(2)
_cell_measurement_temperature    173(2)
_cell_volume                     4552.94(10)
_diffrn_ambient_temperature      173(2)
_exptl_crystal_density_diffrn    1.077
_cod_database_code               4062622
β-Diketiminato Scandium Chemistry: Synthesis, Characterization, and Thermal Behavior of Primary Amido Alkyl Derivatives
Knight, L.; Piers, W. E.; Fleurat-Lessard, P.; Parvez, M.; McDonald, R.; Organometallics 23 (2004) 2087–2094; doi:10.1021/om034345c

data_4062623
_publ_section_title
;
\b-Diketiminato Scandium Chemistry: Synthesis, Characterization, and
Thermal Behavior of Primary Amido Alkyl Derivatives
;
_journal_name_full               Organometallics
_journal_page_first              2087
_journal_page_last               2094
_journal_paper_doi               10.1021/om034345c
_journal_volume                  23
_journal_year                    2004
_chemical_formula_sum            'C39 H62 N3 Sc'
_chemical_formula_weight         617.88
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 96.116(12)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   12.147(3)
_cell_length_b                   17.490(5)
_cell_length_c                   18.028(6)
_cell_measurement_temperature    173(2)
_cell_volume                     3808.3(19)
_diffrn_ambient_temperature      173(2)
_exptl_crystal_density_diffrn    1.078
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               4062623
New Imidate Chromium Complexes from the Metathesis-Like Reaction of Phosphineimines and Chromium (0) Fisher Carbene Complexes
Israel Fernández; María José Mancheño; Mar Gómez-Gallego; Tore Lejon; Lars K. Larsen; Organometallics 23 (2004) 1851–1856; doi:10.1021/om034347x

data_4062624
_publ_section_title
;
New Imidate Chromium Complexes from the Metathesis-Like Reaction
of Phosphineimines and Chromium (0) Fisher Carbene Complexes
;
_journal_issue                   8
_journal_name_full               Organometallics
_journal_page_first              1851
_journal_page_last               1856
_journal_paper_doi               10.1021/om034347x
_journal_volume                  23
_journal_year                    2004
_chemical_formula_sum            'C31 H24 Cr N O5 P'
_chemical_formula_weight         573.51
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 106.01(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   33.327(9)
_cell_length_b                   9.3291(14)
_cell_length_c                   19.595(8)
_cell_measurement_temperature    298(2)
_cell_volume                     5856(3)
_diffrn_ambient_temperature      298(2)
_exptl_crystal_density_diffrn    1.301
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_database_code               4062624
; Organometallics  (2004) –; doi:10.1021/om034359i

data_4062625
_journal_name_full               Organometallics
_journal_paper_doi               10.1021/om034359i
_journal_year                    2004
_chemical_formula_sum            'C79 H84 Fe2 P4'
_chemical_formula_weight         1269.04
_space_group_IT_number           2
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                73.641(5)
_cell_angle_beta                 85.148(5)
_cell_angle_gamma                89.585(5)
_cell_formula_units_Z            2
_cell_length_a                   8.479(5)
_cell_length_b                   19.603(5)
_cell_length_c                   21.125(5)
_cell_measurement_temperature    293(2)
_cell_volume                     3357(2)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.256
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_database_code               4062625
; Organometallics  (2004) –; doi:10.1021/om034363u

data_4062626
_journal_name_full               Organometallics
_journal_paper_doi               10.1021/om034363u
_journal_year                    2004
_chemical_formula_sum            'C27 H27 I N2 Ni'
_chemical_formula_weight         565.12
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                78.76(12)
_cell_angle_beta                 78.19(12)
_cell_angle_gamma                80.52(9)
_cell_formula_units_Z            2
_cell_length_a                   8.854(13)
_cell_length_b                   11.312(13)
_cell_length_c                   12.50(2)
_cell_measurement_temperature    173(2)
_cell_volume                     1192(3)
_diffrn_ambient_temperature      173(2)
_exptl_crystal_density_diffrn    1.574
_cod_database_code               4062626
; Organometallics  (2004) –; doi:10.1021/om034363u

data_4062627
_journal_name_full               Organometallics
_journal_paper_doi               10.1021/om034363u
_journal_year                    2004
_chemical_formula_moiety         'C29 H47 P2 Rh '
_chemical_formula_sum            'C29 H47 P2 Rh'
_chemical_formula_weight         560.54
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                98.4(5)
_cell_angle_beta                 95.920(12)
_cell_angle_gamma                101.5(3)
_cell_formula_units_Z            2
_cell_length_a                   8.86(10)
_cell_length_b                   9.0(2)
_cell_length_c                   18.3(2)
_cell_measurement_temperature    173.0
_cell_volume                     1393.7(34)
_exptl_crystal_density_diffrn    1.336
_cod_original_formula_sum        'C29 H47 P2 Rh '
_cod_database_code               4062627
Wilson, Scott R.; Prussak-Wieckowska, Teresa; Organometallics  (2004) –; doi:10.1021/om034373v

data_4062628
_journal_name_full               Organometallics
_journal_paper_doi               10.1021/om034373v
_journal_year                    2004
_chemical_formula_moiety         'C30 H36 N2 Ni P2 Ru2 S2, C H2 Cl2'
_chemical_formula_sum            'C31 H38 Cl2 N2 Ni P2 Ru2 S2'
_chemical_formula_weight         896.44
_space_group_IT_number           61
_space_group_name_Hall           '-P 2ac 2ab'
_space_group_name_H-M_alt        'P b c a'
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-P 2ac 2ab'
_symmetry_space_group_name_H-M   'P b c a'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   15.181(4)
_cell_length_b                   14.173(4)
_cell_length_c                   35.520(9)
_cell_measurement_temperature    193(2)
_cell_volume                     7642(4)
_diffrn_ambient_temperature      193(2)
_exptl_crystal_density_diffrn    1.558
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Orthorhombic' changed to 'orthorhombic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_sg_symbol_Hall     '-P 2ac 2ab '
_cod_database_code               4062628
Reaction of Diaryldisulfides with RuTp(COD)Cl in N,N'-Dimethylformamide - Formation of 2-Arylmercapto-arylmercaptan Complexes
Standfest-Hauser, Christina M.; Mereiter, Kurt; Schmid, Roland; Kirchner, Karl; Organometallics  (2004) –; doi:10.1021/om034375f

data_4062629
_publ_section_title
;
Reaction of Diaryldisulfides with RuTp(COD)Cl in N,N'-Dimethylformamide -
Formation of 2-Arylmercapto-arylmercaptan Complexes
;
_journal_name_full               Organometallics
_journal_paper_doi               10.1021/om034375f
_journal_year                    2004
_chemical_formula_moiety         'C22 H19 B N6 O Ru S2'
_chemical_formula_sum            'C22 H19 B N6 O Ru S2'
_chemical_formula_weight         559.43
_space_group_IT_number           61
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-P 2ac 2ab'
_symmetry_space_group_name_H-M   'P b c a'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   14.4215(6)
_cell_length_b                   17.3662(7)
_cell_length_c                   18.5927(8)
_cell_measurement_temperature    100(2)
_cell_volume                     4656.5(3)
_diffrn_ambient_temperature      100(2)
_exptl_crystal_density_diffrn    1.596
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Orthorhombic' changed to 'orthorhombic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_database_code               4062629