Hydrostannylation of carbon dioxide by a hydridostannylene molybdenum complex.
Zhu, Qihao; Fettinger, James C.; Power, Philip P.; Dalton transactions (Cambridge, England : 2003) 50 (2021) 12555–12562; doi:10.1039/d1dt02473f

data_7708118
_publ_section_title
;
 Hydrostannylation of carbon dioxide by a hydridostannylene molybdenum
 complex.
;
_journal_issue                   36
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              12555
_journal_page_last               12562
_journal_paper_doi               10.1039/d1dt02473f
_journal_volume                  50
_journal_year                    2021
_chemical_formula_moiety         'C41 H50 Mo O5 Sn'
_chemical_formula_sum            'C41 H50 Mo O5 Sn'
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_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_atom_sites_solution_hydrogens   mixed
_audit_creation_method           SHELXL-2017/1
_audit_update_record
;
2021-05-25 deposited with the CCDC.	2021-08-16 downloaded from the CCDC.
;
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_computing_cell_refinement       'SAINT (8.37a) (Bruker, 2016)'
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_computing_data_reduction        'SAINT (8.37a) (Bruker, 2016)'
_computing_molecular_graphics    'Bruker SHELXTL'
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_diffrn_ambient_temperature      90(2)
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_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       '\f and \w scans'
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_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_limit_l_min       -19
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_diffrn_reflns_point_group_measured_fraction_full 0.999
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_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'TWINABS V2012/1 (Sheldrick, 2012)'
_exptl_crystal_colour            Yellow
_exptl_crystal_density_diffrn    1.405
_exptl_crystal_description       Block
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_refine_ls_extinction_method     none
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_refine_ls_matrix_type           full
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_refine_ls_number_reflns         9055
_refine_ls_number_restraints     145
_refine_ls_restrained_S_all      1.102
_refine_ls_R_factor_all          0.0368
_refine_ls_R_factor_gt           0.0313
_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^)+(0.0411P)^2^+1.4827P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0794
_refine_ls_wR_factor_ref         0.0817
_reflns_Friedel_coverage         0.000
_reflns_number_gt                7878
_reflns_number_total             9055
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            d1dt02473f4.cif
_cod_data_source_block           MMH165F
_cod_depositor_comments
;
The following automatic conversions were performed:

data item '_exptl_absorpt_correction_type' value 'Multi-scan' was
changed to 'multi-scan' in accordance with the
/home/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 last updated on
2011-04-26.

Automatic conversion script
Id: cif_fix_values 7556 2019-12-06 15:28:31Z antanas 

 Adding full bibliography for 7708118--7708120.cif.
;
_cod_database_code               7708118
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_shelx_res_checksum              62499
_shelx_hkl_checksum              639