A photochromic zinc-based coordination polymer for a Li-ion battery anode with high capacity and stable cycling stability.
Xia, Shu-Biao; Li, Fu-Shao; Shen, Xiang; Li, Xue; Cheng, Fei-Xiang; Sun, Cheng-Ke; Guo, Hong; Liu, Jian-Jun; Dalton transactions (Cambridge, England : 2003) 47 (2018) 13222–13228; doi:10.1039/c8dt02930j

data_7047363
_publ_section_title
;
 A photochromic zinc-based coordination polymer for a Li-ion battery anode
 with high capacity and stable cycling stability.
;
_journal_issue                   37
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              13222
_journal_page_last               13228
_journal_paper_doi               10.1039/c8dt02930j
_journal_volume                  47
_journal_year                    2018
_chemical_formula_moiety         'C21 H12 N O7 Zn'
_chemical_formula_sum            'C21 H12 N O7 Zn'
_chemical_formula_weight         455.69
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2014/7
_audit_update_record
;
2018-04-15 deposited with the CCDC.
2018-08-24 downloaded from the CCDC.
;
_cell_angle_alpha                109.152(7)
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_cell_angle_gamma                99.480(6)
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_cell_measurement_temperature    293(2)
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_cell_measurement_theta_min      2.4980
_cell_volume                     974.54(15)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SMART'
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.963
_diffrn_measured_fraction_theta_max 0.963
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_type           MoK\a
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_diffrn_reflns_av_R_equivalents  0.0413
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_diffrn_reflns_point_group_measured_fraction_full 0.963
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_exptl_absorpt_coefficient_mu    1.304
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.76891
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   '(SADABS; Bruker, 2004)'
_exptl_crystal_colour            colorless
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_exptl_crystal_description       needlelike
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_refine_ls_extinction_method     none
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_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.0902P)^2^] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_refine_ls_wR_factor_ref         0.1475
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_reflns_number_gt                2646
_reflns_number_total             3320
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            c8dt02930j2.cif
_cod_data_source_block           Zn-BCP
_cod_depositor_comments          'Adding full bibliography for 7047363.cif.'
_cod_original_cell_volume        974.54(14)
_cod_database_code               7047363
_shelx_shelxl_version_number     2014/7
_shelx_res_checksum              10694
_shelx_fab_checksum              82092