A Neutral Silicon(II) Half-Sandwich Compound.
Heitkemper, Tobias; Sarcevic, Julijan; Sindlinger, Christian P.; Journal of the American Chemical Society 142 (2020) 21304–21309; doi:10.1021/jacs.0c11904

data_4135395
_publ_section_title
;
 A Neutral Silicon(II) Half-Sandwich Compound.
;
_journal_issue                   51
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              21304
_journal_page_last               21309
_journal_paper_doi               10.1021/jacs.0c11904
_journal_volume                  142
_journal_year                    2020
_chemical_formula_sum            'C162 H257 B3 Si9'
_chemical_formula_weight         2489.90
_space_group_crystal_system      triclinic
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_space_group_name_Hall           '-P 1'
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_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2018/3
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_cell_length_c                   28.024(3)
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_computing_publication_material  'Bruker SHELXTL'
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_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 0.995
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       '\f and \w scans'
_diffrn_radiation_type           MoK\a
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_diffrn_reflns_av_unetI/netI     0.0646
_diffrn_reflns_Laue_measured_fraction_full 1.000
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_diffrn_reflns_limit_k_min       -33
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_exptl_absorpt_coefficient_mu    0.116
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_exptl_absorpt_correction_T_min  0.4494
_exptl_absorpt_correction_type   multi-scan
_exptl_crystal_colour            colourless
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_refine_ls_extinction_method     none
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_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.1121P)^2^+12.6157P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.2433
_refine_ls_wR_factor_ref         0.2700
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_reflns_number_gt                24251
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_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            ja0c11904_si_003.cif
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_cod_depositor_comments
'Adding full bibliography for 4135395--4135397.cif.'
_cod_original_cell_volume        8304.8(17)
_cod_database_code               4135395
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_shelx_res_checksum              46374
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