Trinuclear cationic silver nanoclusters based-on bis-(phosphine) ligands and stabilized by CF3SO3− anions
Han, Chu-Xia; Shao, Zi-Mo; Li, Li; Zhou, Kun; Xue, Chun-Hui; Chen, Bao-Kuan; Ji, Jiu-Yu; Bi, Yan-Feng; New Journal of Chemistry 45 (2021) 7555–7563; doi:10.1039/D1NJ00873K

data_7060495
_publ_section_title
;
 Trinuclear cationic silver nanoclusters based-on bis-(phosphine) ligands
 and stabilized by CF3SO3&#x2212; anions
;
_journal_issue                   17
_journal_name_full               'New Journal of Chemistry'
_journal_page_first              7555
_journal_page_last               7563
_journal_paper_doi               10.1039/D1NJ00873K
_journal_volume                  45
_journal_year                    2021
_chemical_formula_sum            'C85 H87 Ag3 Cl2 F3 N3 O6 P6 S'
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_audit_update_record
;
2021-03-23 deposited with the CCDC.	2021-03-25 downloaded from the CCDC.
;
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_cell_volume                     8647.1(11)
_computing_cell_refinement       'SAINT V8.38A (Bruker AXS Inc., 2017)'
_computing_data_collection       'Bruker Instrument Service vV6.2.9'
_computing_data_reduction        'SAINT V8.38A (Bruker AXS Inc., 2017)'
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_computing_structure_refinement  'SHELXL-2017/1 (Sheldrick, 2017)'
_computing_structure_solution    'SHELXT 2014/5 (Sheldrick, 2014)'
_diffrn_ambient_temperature      296(2)
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_diffrn_measured_fraction_theta_max 0.997
_diffrn_measurement_device_type  'Bruker D8 QUEST'
_diffrn_measurement_method       '\f and \w scans'
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_diffrn_reflns_Laue_measured_fraction_full 0.997
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_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_number            75082
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_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
SADABS-2016/2 - Bruker AXS area detector scaling and absorption correction
;
_exptl_crystal_colour            colourless
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_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.0455P)^2^+9.7158P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0931
_refine_ls_wR_factor_ref         0.1026
_reflns_Friedel_coverage         0.000
_reflns_number_gt                12051
_reflns_number_total             15350
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            d1nj00873k2.cif
_cod_data_source_block           Ag3_3
_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 7060493--7060495.cif.
;
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               7060495
_shelx_shelxl_version_number     2017/1
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_shelx_estimated_absorpt_t_max   0.889
_shelx_res_checksum              22875