Steric effects in the reactions of amidinate germylenes with ruthenium carbonyl: isolation of a coordinatively unsaturated diruthenium(0) derivative
Cabeza, Javier A.; Fernández-Colinas, José M.; García-Álvarez, Pablo; Polo, Diego; RSC Advances 4 (2014) 31503–; doi:10.1039/C4RA05972G

data_7217196
_publ_section_title
;
 Steric effects in the reactions of amidinate germylenes with ruthenium
 carbonyl: isolation of a coordinatively unsaturated diruthenium(0)
 derivative
;
_journal_issue                   59
_journal_name_full               'RSC Advances'
_journal_page_first              31503
_journal_paper_doi               10.1039/C4RA05972G
_journal_volume                  4
_journal_year                    2014
_chemical_formula_moiety         'C42 H53 Ge N3 O5 Ru2 Si2 Sn, C7 H8'
_chemical_formula_sum            'C49 H61 Ge N3 O5 Ru2 Si2 Sn'
_chemical_formula_weight         1221.61
_chemical_name_systematic
;
 ?
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_space_group_IT_number           2
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_symmetry_space_group_name_Hall  '-P 1'
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_computing_cell_refinement
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CrysAlisPro, Agilent Technologies,
Version 1.171.36.28 (release 01-02-2013 CrysAlis171 .NET)
(compiled Feb  1 2013,16:14:44)
;
_computing_data_collection
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CrysAlisPro, Agilent Technologies,
Version 1.171.36.28 (release 01-02-2013 CrysAlis171 .NET)
(compiled Feb  1 2013,16:14:44)
;
_computing_data_reduction
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CrysAlisPro, Agilent Technologies,
Version 1.171.36.28 (release 01-02-2013 CrysAlis171 .NET)
(compiled Feb  1 2013,16:14:44)
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_computing_molecular_graphics    'MERCUY CSD 3.1 (Build RC5)'
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_computing_structure_solution    'SIR-97 (Giacovazzo, 1999)'
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_diffrn_measurement_device_type  'Xcalibur, Onyx, Nova'
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_diffrn_radiation_source         'Nova (Cu) X-ray Source'
_diffrn_radiation_type           'Cu K\a'
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_diffrn_reflns_number            19749
_diffrn_reflns_theta_full        67.98
_diffrn_reflns_theta_max         67.98
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_exptl_absorpt_coefficient_mu    9.680
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_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
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CrysAlisPro, Agilent Technologies,
Version 1.171.36.28 (release 01-02-2013 CrysAlis171 .NET)
(compiled Feb  1 2013,16:14:44)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            orange
_exptl_crystal_density_diffrn    1.532
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       fragment
_exptl_crystal_F_000             1228
_exptl_crystal_size_max          0.2435
_exptl_crystal_size_mid          0.0863
_exptl_crystal_size_min          0.0811
_refine_diff_density_max         0.627
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_refine_ls_R_factor_all          0.0310
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_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[\s^2^(Fo^2^)+(0.0298P)^2^+0.0000P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0577
_refine_ls_wR_factor_ref         0.0622
_reflns_number_gt                8416
_reflns_number_total             9561
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c4ra05972g2.cif
_cod_data_source_block           xn13_012_dp523
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'TRICLINIC' changed to 'triclinic'
according to
/usr/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 2281 2013-09-26 08:29:07Z andrius 
;
_cod_original_cell_volume        2649.05(15)
_cod_database_code               7217196