Formation of Trigons in a Metal-Organic Framework: The Role of Metal-Organic Polyhedron Subunits as Meta-Atoms
Lee, Jiyoung; Choi, Jae Sun; Jeong, Nak Cheon; Choe, Wonyoung; Chemical Science  (2019) –; doi:10.1039/C9SC00513G

data_1551045
_publ_section_title
;
 Formation of Trigons in a Metal-Organic Framework: The Role of
 Metal-Organic Polyhedron Subunits as Meta-Atoms
;
_journal_name_full               'Chemical Science'
_journal_paper_doi               10.1039/C9SC00513G
_journal_year                    2019
_chemical_formula_sum            'C324 H240 Cu12 N12 O108 Zn12'
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_space_group_name_Hall           '-F 4 2 3'
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_symmetry_space_group_name_Hall  '-F 4 2 3'
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_audit_update_record
;
2018-09-03 deposited with the CCDC.    2019-05-08 downloaded from the CCDC.
;
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_diffrn_measurement_method       'omega scan'
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_exptl_crystal_description       'truncated octahedron'
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_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.1530P)^2^+176.0708P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.2707
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_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            c9sc00513g2.cif
_cod_data_source_block           1
_cod_depositor_comments
;
The following automatic conversions were performed:

'_exptl_absorpt_correction_type' value 'Multi-scan' changed to
'multi-scan' according to
/home/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 4973 2017-02-22 13:04:09Z antanas 
;
_cod_original_cell_volume        100252(35)
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