Interlinking supertetrahedral chalcogenolate clusters with bipyridines to form two-dimensional coordination polymers for photocatalytic degradation of organic dye.
Xu, Chao; Sheng, Ming-Ming; Shi, Hua-Tian; Strømme, Maria; Zhang, Qian-Feng; Dalton transactions (Cambridge, England : 2003) 48 (2019) 5505–5510; doi:10.1039/c9dt00480g

data_7049526
_publ_section_title
;
 Interlinking supertetrahedral chalcogenolate clusters with bipyridines to
 form two-dimensional coordination polymers for photocatalytic degradation
 of organic dye.
;
_journal_issue                   17
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              5505
_journal_page_last               5510
_journal_paper_doi               10.1039/c9dt00480g
_journal_volume                  48
_journal_year                    2019
_chemical_formula_moiety         'C122 H108 Ag4 Cd6 N4 S16, C12 H28 N4 O4'
_chemical_formula_sum            'C134 H136 Ag4 Cd6 N8 O4 S16'
_chemical_formula_weight         3541.34
_space_group_crystal_system      monoclinic
_space_group_IT_number           15
_space_group_name_Hall           '-C 2yc'
_space_group_name_H-M_alt        'C 1 2/c 1'
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2016/6
_audit_update_record
;
2019-03-20 deposited with the CCDC.    2019-03-27 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 98.1050(10)
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_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      20.74
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_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'Bruker SHELXTL'
_computing_structure_solution    'Bruker SHELXTL'
_diffrn_ambient_temperature      296(2)
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0811
_diffrn_reflns_av_unetI/netI     0.0814
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_diffrn_reflns_limit_h_min       -23
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_diffrn_reflns_point_group_measured_fraction_full 0.999
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_exptl_absorpt_correction_T_max  0.721
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_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
SADABS-2008/1 (Bruker,2008) was used for absorption correction. 
The Ratio of minimum to maximum transmission is 0.928.
The \l/2 correction factor is 0.0015.
;
_exptl_crystal_colour            colourless
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_exptl_crystal_description       flake
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_refine_ls_number_restraints     1986
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_refine_ls_R_factor_all          0.1288
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_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.0779P)^2^] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1486
_refine_ls_wR_factor_ref         0.1698
_reflns_Friedel_coverage         0.000
_reflns_number_gt                12574
_reflns_number_total             24361
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            c9dt00480g2.cif
_cod_data_source_block           c2c_S
_cod_depositor_comments
'Adding full bibliography for 7049526--7049529.cif.'
_cod_database_code               7049526
_shelx_shelxl_version_number     2016/6
_shelx_estimated_absorpt_t_min   0.669
_shelx_estimated_absorpt_t_max   0.721
_shelx_res_checksum              60997
_shelx_fab_checksum              6230