Polyanionic clusters embedded in lattice-type hydrogen bonding networks involving in situ bond activation and coupling of organic cations
Han, Zhan-Gang; Liu, Yun-Ping; Zhao, Xiao-Fang; Yan, Jin-Shuang; Zhai, Xue-Liang; CrystEngComm 17 (2015) 7339–; doi:10.1039/C5CE01220A

data_7221798
_publ_section_title
;
 Polyanionic clusters embedded in lattice-type hydrogen bonding networks
 involving in situ bond activation and coupling of organic cations
;
_journal_issue                   38
_journal_name_full               CrystEngComm
_journal_page_first              7339
_journal_paper_doi               10.1039/C5CE01220A
_journal_volume                  17
_journal_year                    2015
_chemical_formula_sum            'C52 H44 Al Co N8 O43 W12'
_chemical_formula_weight         3761.04
_chemical_name_systematic
;
 ?
;
_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-2014
_audit_update_record
;
2015-08-11 deposited with the CCDC.
2015-08-13 downloaded from the CCDC.
;
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_cell_measurement_theta_min      2.66
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_computing_cell_refinement       'Bruker SMART'
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_computing_structure_solution    'Bruker SHELXTL'
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_diffrn_radiation_type           MoK\a
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_diffrn_reflns_point_group_measured_fraction_full 0.972
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_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.0324P)^2^+1764.0109P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1670
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_reflns_Friedel_coverage         0.000
_reflns_number_gt                5379
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_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            c5ce01220a2.cif
_cod_data_source_block           1405996
_cod_depositor_comments
;
The following automatic conversions were performed:

'_exptl_crystal_density_meas' value 'none' was changed to '?' - the
value is perceived as not measured.

Automatic conversion script
Id: cif_fix_values 3271 2015-04-21 07:52:19Z andrius 

 Adding full bibliography for 7221797--7221798.cif.
;
_cod_original_cell_volume        7638.9(16)
_cod_database_code               7221798
_shelxl_version_number           2014-3
_shelx_res_checksum              67418