Two-dimensional square-grid iron(ii) coordination polymers showing anion-dependent spin crossover behavior
Shin, Jong Won; Jeong, Ah Rim; Jeong, Jong Hwa; Zenno, Hikaru; Hayami, Shinya; Min, Kil Sik; RSC Advances 10 (2020) 5040–5049; doi:10.1039/C9RA09782A

data_7239857
_publ_section_title
;
 Two-dimensional square-grid iron(ii) coordination polymers showing
 anion-dependent spin crossover behavior
;
_journal_issue                   9
_journal_name_full               'RSC Advances'
_journal_page_first              5040
_journal_page_last               5049
_journal_paper_doi               10.1039/C9RA09782A
_journal_volume                  10
_journal_year                    2020
_chemical_formula_sum            'C46 H45 Fe N14 O3 Se2'
_chemical_formula_weight         1055.72
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2ybc'
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_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2013
_audit_update_record
;
2019-08-09 deposited with the CCDC.	2020-01-24 downloaded from the CCDC.
;
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;
;
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_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc^2^\l^3^/sin(2\q)]^-1/4^
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_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
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;
 w=1/[\s^2^(Fo^2^)+(0.1751P)^2^+4.5218P]
 where P=(Fo^2^+2Fc^2^)/3
;
_refine_ls_weighting_scheme      calc
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_cod_data_source_file            c9ra09782a2.cif
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_cod_depositor_comments
'Adding full bibliography for 7239855--7239857.cif.'
_cod_original_cell_volume        2743.1(10)
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               7239857
_shelx_estimated_absorpt_t_min   0.729
_shelx_estimated_absorpt_t_max   0.896
_shelxl_version_number           2013-2