LMucko/crystallography-open-database huggingface dataset:
C2-Symmetric Fluorous Diamino-Dialkoxide Complexes of Early Transition Metals
Lavanant, Laurent; Chou, Tsung-Yi; Chi, Yun; Lehmann, Christian W.; Toupet, Loic; Carpentier, Jean-François; Organometallics 23 (2004) 5450–5458; doi:10.1021/om0494364

data_4061044
_publ_section_title
;
 C2-Symmetric Fluorous Diamino-Dialkoxide Complexes of Early Transition Metals
;
_journal_coden_ASTM              ORGND7
_journal_issue                   23
_journal_name_full               Organometallics
_journal_page_first              5450
_journal_page_last               5458
_journal_paper_doi               10.1021/om0494364
_journal_volume                  23
_journal_year                    2004
_chemical_formula_moiety         'C12 H14 Cl2 F12 N2 O2 Ti'
_chemical_formula_sum            'C12 H14 Cl2 F12 N2 O2 Ti'
_chemical_formula_weight         565.05
_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                71.9240(10)
_cell_angle_beta                 83.218(2)
_cell_angle_gamma                80.626(2)
_cell_formula_units_Z            2
_cell_length_a                   7.3661(2)
_cell_length_b                   10.8162(4)
_cell_length_c                   12.8858(5)
_cell_measurement_temperature    100
_cell_volume                     960.45(6)
_diffrn_ambient_temperature      100
_exptl_crystal_density_diffrn    1.954
_cod_depositor_comments
;
The following automatic conversions were performed:
'_geom_bond_publ_flag' value 'N' changed to 'n' according to
'/home/saulius/struct/CIF-dictionaries/cif_core.dic' dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29 (14 times).

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_database_code               4061044
C2-Symmetric Fluorous Diamino-Dialkoxide Complexes of Early Transition Metals
Lavanant, Laurent; Chou, Tsung-Yi; Chi, Yun; Lehmann, Christian W.; Toupet, Loic; Carpentier, Jean-François; Organometallics 23 (2004) 5450–5458; doi:10.1021/om0494364

data_4061045
_publ_section_title
;
 C2-Symmetric Fluorous Diamino-Dialkoxide Complexes of Early Transition Metals
;
_journal_coden_ASTM              ORGND7
_journal_issue                   23
_journal_name_full               Organometallics
_journal_page_first              5450
_journal_page_last               5458
_journal_paper_doi               10.1021/om0494364
_journal_volume                  23
_journal_year                    2004
_chemical_formula_moiety         'C26 H28 F12 N2 O2 Zr'
_chemical_formula_sum            'C26 H28 F12 N2 O2 Zr'
_chemical_formula_weight         719.72
_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                 117.97
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   16.5131(2)
_cell_length_b                   11.63810(10)
_cell_length_c                   17.0637(2)
_cell_measurement_temperature    100
_cell_volume                     2896.17(5)
_diffrn_ambient_temperature      100
_exptl_crystal_density_diffrn    1.651
_cod_depositor_comments
;
The following automatic conversions were performed:
'_geom_bond_publ_flag' value 'N' changed to 'n' according to
'/home/saulius/struct/CIF-dictionaries/cif_core.dic' dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29 (28 times).

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_sg_symbol_Hall     P21/n
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               4061045
C2-Symmetric Fluorous Diamino-Dialkoxide Complexes of Early Transition Metals
Lavanant, Laurent; Chou, Tsung-Yi; Chi, Yun; Lehmann, Christian W.; Toupet, Loic; Carpentier, Jean-François; Organometallics 23 (2004) 5450–5458; doi:10.1021/om0494364

data_4061046
_publ_section_title
;
 C2-Symmetric Fluorous Diamino-Dialkoxide Complexes of Early Transition Metals
;
_journal_coden_ASTM              ORGND7
_journal_issue                   23
_journal_name_full               Organometallics
_journal_page_first              5450
_journal_page_last               5458
_journal_paper_doi               10.1021/om0494364
_journal_volume                  23
_journal_year                    2004
_chemical_formula_sum            'C20 H33 F12 N2 O3 Si Y'
_chemical_formula_weight         694.48
_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                 97.594(2)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   10.2291(2)
_cell_length_b                   16.7352(4)
_cell_length_c                   16.8838(4)
_cell_measurement_temperature    120(1)
_cell_volume                     2864.92(11)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.610
_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               4061046
Ruthenium Arene Derivatives with PN Hemilabile Ligands. P‒C Cleavage and Phosphine to Phosphinite Transformation
Caballero, Agustín; Jalón, Félix A.; Manzano, Blanca R.; Espino, Gustavo; Pérez-Manrique, Mercedes; Mucientes, Antonio; Poblete, Francisco J.; Maestro, Miguel; Organometallics 23 (2004) 5694–5706; doi:10.1021/om049438o

data_4061047
_publ_section_title
;
 Ruthenium Arene Derivatives with PN Hemilabile Ligands.
 P--C Cleavage and Phosphine to Phosphinite Transformation
;
_journal_coden_ASTM              ORGND7
_journal_issue                   24
_journal_name_full               Organometallics
_journal_page_first              5694
_journal_page_last               5706
_journal_paper_doi               10.1021/om049438o
_journal_volume                  23
_journal_year                    2004
_chemical_formula_moiety         'C26 H29 Cl N2 P Ru, 0.5 (C H2 Cl2)'
_chemical_formula_sum            'C26.5 H30 Cl3 N2 P Ru'
_chemical_formula_weight         614.91
_space_group_IT_number           13
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yac'
_symmetry_space_group_name_H-M   'P 1 2/n 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 96.701(1)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   14.1253(9)
_cell_length_b                   10.7073(7)
_cell_length_c                   17.442(1)
_cell_measurement_temperature    173(2)
_cell_volume                     2620.0(3)
_diffrn_ambient_temperature      173(2)
_exptl_crystal_density_diffrn    1.559
_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 2/n'
_cod_original_formula_sum        'C26.50 H30 Cl3 N2 P Ru'
_cod_database_code               4061047
Ruthenium Arene Derivatives with PN Hemilabile Ligands. P‒C Cleavage and Phosphine to Phosphinite Transformation
Caballero, Agustín; Jalón, Félix A.; Manzano, Blanca R.; Espino, Gustavo; Pérez-Manrique, Mercedes; Mucientes, Antonio; Poblete, Francisco J.; Maestro, Miguel; Organometallics 23 (2004) 5694–5706; doi:10.1021/om049438o

data_4061048
_publ_section_title
;
 Ruthenium Arene Derivatives with PN Hemilabile Ligands.
 P--C Cleavage and Phosphine to Phosphinite Transformation
;
_journal_coden_ASTM              ORGND7
_journal_issue                   24
_journal_name_full               Organometallics
_journal_page_first              5694
_journal_page_last               5706
_journal_paper_doi               10.1021/om049438o
_journal_volume                  23
_journal_year                    2004
_chemical_formula_moiety         'C22 H21 Cl2 N2 P Ru, 2(Cl2CH2)'
_chemical_formula_sum            'C24 H25 Cl6 N2 P Ru'
_chemical_formula_weight         686.20
_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                 127.4090(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   36.913(2)
_cell_length_b                   7.6915(4)
_cell_length_c                   24.961(1)
_cell_measurement_temperature    298(2)
_cell_volume                     5629.2(5)
_diffrn_ambient_temperature      298(2)
_exptl_crystal_density_diffrn    1.619
_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               4061048
Ruthenium Arene Derivatives with PN Hemilabile Ligands. P‒C Cleavage and Phosphine to Phosphinite Transformation
Caballero, Agustín; Jalón, Félix A.; Manzano, Blanca R.; Espino, Gustavo; Pérez-Manrique, Mercedes; Mucientes, Antonio; Poblete, Francisco J.; Maestro, Miguel; Organometallics 23 (2004) 5694–5706; doi:10.1021/om049438o

data_4061049
_publ_section_title
;
 Ruthenium Arene Derivatives with PN Hemilabile Ligands.
 P--C Cleavage and Phosphine to Phosphinite Transformation
;
_journal_coden_ASTM              ORGND7
_journal_issue                   24
_journal_name_full               Organometallics
_journal_page_first              5694
_journal_page_last               5706
_journal_paper_doi               10.1021/om049438o
_journal_volume                  23
_journal_year                    2004
_chemical_formula_moiety         'C26 H30 Cl2 N2 P Ru, 1(B F4), 1(C H2 Cl2)'
_chemical_formula_sum            'C27 H32 B Cl4 F4 N2 P Ru'
_chemical_formula_weight         745.20
_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                 92.015(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   12.661(2)
_cell_length_b                   16.226(3)
_cell_length_c                   15.069(3)
_cell_measurement_temperature    173(2)
_cell_volume                     3093.9(9)
_diffrn_ambient_temperature      173(2)
_exptl_crystal_density_diffrn    1.600
_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               4061049
Ruthenium Arene Derivatives with PN Hemilabile Ligands. P‒C Cleavage and Phosphine to Phosphinite Transformation
Caballero, Agustín; Jalón, Félix A.; Manzano, Blanca R.; Espino, Gustavo; Pérez-Manrique, Mercedes; Mucientes, Antonio; Poblete, Francisco J.; Maestro, Miguel; Organometallics 23 (2004) 5694–5706; doi:10.1021/om049438o

data_4061050
_publ_section_title
;
 Ruthenium Arene Derivatives with PN Hemilabile Ligands.
 P--C Cleavage and Phosphine to Phosphinite Transformation
;
_journal_coden_ASTM              ORGND7
_journal_issue                   24
_journal_name_full               Organometallics
_journal_page_first              5694
_journal_page_last               5706
_journal_paper_doi               10.1021/om049438o
_journal_volume                  23
_journal_year                    2004
_chemical_formula_moiety         'C22 H22 Cl2 N2 P Ru, B F4'
_chemical_formula_sum            'C22 H22 B Cl2 F4 N2 P Ru'
_chemical_formula_weight         604.17
_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                 94.892(12)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   10.180(6)
_cell_length_b                   13.035(7)
_cell_length_c                   17.884(10)
_cell_measurement_temperature    173(2)
_cell_volume                     2364(2)
_diffrn_ambient_temperature      173(2)
_exptl_crystal_density_diffrn    1.697
_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               4061050
Unexpected Formation of the Vinyl‒Phosphonio Complex [CpRu(PPh3)(C6H4PPh2CHCH2)][PF6] from a Vinylidene Complex via Nucleophilic Addition and Ortho Metalation of Triphenylphosphine
Onitsuka, Kiyotaka; Nishii, Masayoshi; Matsushima, Yuji; Takahashi, Shigetoshi; Organometallics 23 (2004) 5630–5632; doi:10.1021/om049440f

data_4061051
_publ_section_title
;
 Unexpected Formation of the Vinyl--Phosphonio Complex
 [CpRu(PPh3)(C6H4PPh2CHCH2)][PF6] from a Vinylidene Complex
 via Nucleophilic Addition and Ortho Metalation of Triphenylphosphine
;
_journal_coden_ASTM              ORGND7
_journal_issue                   23
_journal_name_full               Organometallics
_journal_page_first              5630
_journal_page_last               5632
_journal_paper_doi               10.1021/om049440f
_journal_volume                  23
_journal_year                    2004
_chemical_formula_moiety         'C48 H47 F6 P3 Ru '
_chemical_formula_sum            'C48 H47 F6 P3 Ru'
_chemical_formula_weight         931.88
_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                 93.51(3)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   12.366(6)
_cell_length_b                   30.378(5)
_cell_length_c                   11.245(5)
_cell_measurement_temperature    203.1
_cell_volume                     4216(2)
_exptl_crystal_density_diffrn    1.468
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_original_formula_sum        'C48 H47 F6 P3 Ru '
_cod_database_code               4061051
Reaction of Palladium 1,5-Cyclooctadiene Alkyl Chloride with Norbornene Derivatives: Relevance to Metal-Catalyzed Addition Polymerization of Functionalized Norbornenes
Kang, Myeongsoon; Sen, Ayusman; Organometallics 23 (2004) 5396–5398; doi:10.1021/om049449h

data_4061052
_publ_section_title
;
 Reaction of Palladium 1,5-Cyclooctadiene Alkyl Chloride with Norbornene
 Derivatives: Relevance to Metal-Catalyzed Addition Polymerization
 of Functionalized Norbornenes
;
_journal_coden_ASTM              ORGND7
_journal_issue                   23
_journal_name_full               Organometallics
_journal_page_first              5396
_journal_page_last               5398
_journal_paper_doi               10.1021/om049449h
_journal_volume                  23
_journal_year                    2004
_chemical_formula_sum            'C16 H25 Cl Pd'
_chemical_formula_weight         359.21
_chemical_name_common            (COD)Pd(Cl)(2-Me-norbornanyl)
_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                 108.150(13)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   10.899(5)
_cell_length_b                   12.530(5)
_cell_length_c                   11.467(5)
_cell_measurement_temperature    95(2)
_cell_volume                     1488.1(10)
_diffrn_ambient_temperature      95(2)
_exptl_crystal_density_diffrn    1.603
_cod_depositor_comments
;
 Updating bibliography.

 Antanas Vaitkus,
 2017-07-07

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               4061052
Reaction of Palladium 1,5-Cyclooctadiene Alkyl Chloride with Norbornene Derivatives: Relevance to Metal-Catalyzed Addition Polymerization of Functionalized Norbornenes
Kang, Myeongsoon; Sen, Ayusman; Organometallics 23 (2004) 5396–5398; doi:10.1021/om049449h

data_4061053
_publ_section_title
;
 Reaction of Palladium 1,5-Cyclooctadiene Alkyl Chloride with Norbornene
 Derivatives: Relevance to Metal-Catalyzed Addition Polymerization
 of Functionalized Norbornenes
;
_journal_coden_ASTM              ORGND7
_journal_issue                   23
_journal_name_full               Organometallics
_journal_page_first              5396
_journal_page_last               5398
_journal_paper_doi               10.1021/om049449h
_journal_volume                  23
_journal_year                    2004
_chemical_formula_sum            'C19 H29 Cl O2 Pd'
_chemical_formula_weight         431.27
_chemical_name_common            (COD)Pd(Cl)(2-Me-5-endo-ethylester-norbornanyl)
_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                105.751(3)
_cell_angle_beta                 90.578(4)
_cell_angle_gamma                109.872(4)
_cell_formula_units_Z            2
_cell_length_a                   8.0473(17)
_cell_length_b                   10.216(2)
_cell_length_c                   12.347(3)
_cell_measurement_temperature    95(2)
_cell_volume                     912.9(3)
_diffrn_ambient_temperature      95(2)
_exptl_crystal_density_diffrn    1.569
_cod_depositor_comments
;
 Updating bibliography.

 Antanas Vaitkus,
 2017-07-07

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_original_sg_symbol_H-M      'P 1'
_cod_database_code               4061053
Reaction of Palladium 1,5-Cyclooctadiene Alkyl Chloride with Norbornene Derivatives: Relevance to Metal-Catalyzed Addition Polymerization of Functionalized Norbornenes
Kang, Myeongsoon; Sen, Ayusman; Organometallics 23 (2004) 5396–5398; doi:10.1021/om049449h

data_4061054
_publ_section_title
;
 Reaction of Palladium 1,5-Cyclooctadiene Alkyl Chloride with Norbornene
 Derivatives: Relevance to Metal-Catalyzed Addition Polymerization
 of Functionalized Norbornenes
;
_journal_coden_ASTM              ORGND7
_journal_issue                   23
_journal_name_full               Organometallics
_journal_page_first              5396
_journal_page_last               5398
_journal_paper_doi               10.1021/om049449h
_journal_volume                  23
_journal_year                    2004
_chemical_formula_sum            'C19 H29 Cl O2 Pd'
_chemical_formula_weight         431.27
_chemical_name_common            (COD)Pd(Cl)(2-Me-5-exo-ethylester-norbornanyl)
_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                 92.048(4)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   11.240(2)
_cell_length_b                   13.031(3)
_cell_length_c                   12.463(2)
_cell_measurement_temperature    96(2)
_cell_volume                     1824.3(6)
_diffrn_ambient_temperature      96(2)
_exptl_crystal_density_diffrn    1.570
_cod_depositor_comments
;
 Updating bibliography.

 Antanas Vaitkus,
 2017-07-07

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               4061054
Reaction of Palladium 1,5-Cyclooctadiene Alkyl Chloride with Norbornene Derivatives: Relevance to Metal-Catalyzed Addition Polymerization of Functionalized Norbornenes
Kang, Myeongsoon; Sen, Ayusman; Organometallics 23 (2004) 5396–5398; doi:10.1021/om049449h

data_4061055
_publ_section_title
;
 Reaction of Palladium 1,5-Cyclooctadiene Alkyl Chloride with Norbornene
 Derivatives: Relevance to Metal-Catalyzed Addition Polymerization
 of Functionalized Norbornenes
;
_journal_coden_ASTM              ORGND7
_journal_issue                   23
_journal_name_full               Organometallics
_journal_page_first              5396
_journal_page_last               5398
_journal_paper_doi               10.1021/om049449h
_journal_volume                  23
_journal_year                    2004
_chemical_formula_sum            'C19 H29 Cl O2 Pd'
_chemical_formula_weight         431.27
_chemical_name_common
(COD)Pd(Cl)(2-Me-5-endo-methylacetate-norbornanyl)
_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                 96.614(4)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   6.8659(17)
_cell_length_b                   23.248(6)
_cell_length_c                   11.502(3)
_cell_measurement_temperature    293(2)
_cell_volume                     1823.7(8)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.571
_cod_depositor_comments
;
 Updating bibliography.

 Antanas Vaitkus,
 2017-07-07

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               4061055