New Vinylgermanium Derivatives of Silsesquioxanes and Their Ruthenium Complexes—Synthesis, Structure, and Reactivity
Frąckowiak, Dawid; Żak, Patrycja; Spólnik, Grzegorz; Pyziak, Mikołaj; Marciniec, Bogdan; Organometallics 34 (2015) 3950–; doi:10.1021/acs.organomet.5b00142

data_4086144
_publ_contact_author
; 'Marciniec, Bogdan'
  Department of Chemistry
  Adam Mickiewicz University
  ul. Umultowska 89b            
  60-614 Pozna\'n  
  Poland
;
_publ_section_title
;
 New Vinylgermanium Derivatives of Silsesquioxanes and Their Ruthenium
 Complexes---Synthesis, Structure, and Reactivity
;
_journal_issue                   16
_journal_name_full               Organometallics
_journal_page_first              3950
_journal_paper_doi               10.1021/acs.organomet.5b00142
_journal_volume                  34
_journal_year                    2015
_chemical_formula_sum            'C84 H117 Cl Ge O13 P2 Ru Si7'
_chemical_formula_weight         1802.52
_chemical_name_systematic
;
 ?
;
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
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_diffrn_ambient_temperature      130(2)
_diffrn_detector                 'CCD plate'
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_diffrn_measured_fraction_theta_max 0.958
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'SuperNova, Single source at offset, Atlas'
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_diffrn_radiation_type           CuK\a
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_diffrn_reflns_limit_h_max       19
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_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -24
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_diffrn_reflns_point_group_measured_fraction_full 0.993
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_diffrn_reflns_theta_full        67.684
_diffrn_reflns_theta_max         75.612
_diffrn_reflns_theta_min         2.274
_diffrn_source                   'sealed X-ray tube'
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_exptl_absorpt_correction_type   multi-scan
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_exptl_crystal_description       plate
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_exptl_crystal_size_mid          0.03
_exptl_crystal_size_min          0.01
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_refine_diff_density_min         -1.730
_refine_diff_density_rms         0.125
_refine_ls_extinction_method     none
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_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1048
_refine_ls_number_reflns         17865
_refine_ls_number_restraints     18
_refine_ls_restrained_S_all      0.810
_refine_ls_R_factor_all          0.0919
_refine_ls_R_factor_gt           0.0691
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.2000P)^2^] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1902
_refine_ls_wR_factor_ref         0.2313
_reflns_Friedel_coverage         0.000
_reflns_number_gt                13020
_reflns_number_total             17865
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            om5b00142_si_005.cif
_cod_data_source_block           7d
_cod_depositor_comments          'Adding full bibliography for 4086144.cif.'
_cod_database_code               4086144
_shelxl_version_number           2014-3
_shelx_res_checksum              88033
_shelx_hkl_checksum              74282