Upcycling of nonporous coordination polymers: controllable-conversion toward porosity-tuned N-doped carbons and their electrocatalytic activity in seawater batteries
Jeoung, Sungeun; Sahgong, Sun Hye; Kim, Jae Hyung; Hwang, Soo Min; Kim, Youngsik; Moon, Hoi Ri; Journal of Materials Chemistry A 4 (2016) 13468–; doi:10.1039/C6TA05102B

data_7236339
_publ_section_title
;
 Upcycling of nonporous coordination polymers: controllable-conversion
 toward porosity-tuned N-doped carbons and their electrocatalytic activity
 in seawater batteries
;
_journal_issue                   35
_journal_name_full               'Journal of Materials Chemistry A'
_journal_page_first              13468
_journal_paper_doi               10.1039/C6TA05102B
_journal_volume                  4
_journal_year                    2016
_chemical_formula_moiety         'C104 H88 N24 O20 Zn4'
_chemical_formula_sum            'C104 H88 N24 O20 Zn4'
_chemical_formula_weight         2255.46
_chemical_name_common            ZnMOFazo
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2014/7
_audit_update_record
;
2016-05-19 deposited with the CCDC.
2016-08-01 downloaded from the CCDC.
;
_cell_angle_alpha                89.57(3)
_cell_angle_beta                 78.43(3)
_cell_angle_gamma                70.48(3)
_cell_formula_units_Z            2
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_cell_measurement_reflns_used    32101
_cell_measurement_temperature    173(2)
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_computing_cell_refinement       'Rigaku Rapid Auto'
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_computing_structure_solution    SHELXT
_diffrn_ambient_temperature      173(2)
_diffrn_measured_fraction_theta_full 0.988
_diffrn_measured_fraction_theta_max 0.971
_diffrn_measurement_device_type  'imaging plate'
_diffrn_measurement_method       'omega scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0488
_diffrn_reflns_av_unetI/netI     0.0700
_diffrn_reflns_Laue_measured_fraction_full 0.988
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_diffrn_reflns_limit_h_max       19
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_diffrn_reflns_number            49468
_diffrn_reflns_point_group_measured_fraction_full 0.988
_diffrn_reflns_point_group_measured_fraction_max 0.971
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         27.476
_diffrn_reflns_theta_min         3.011
_diffrn_source                   'fine-focus sealed tube'
_exptl_absorpt_coefficient_mu    1.019
_exptl_absorpt_correction_T_max  0.955
_exptl_absorpt_correction_T_min  0.876
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'Rigaku Rapid Auto'
_exptl_crystal_colour            orange
_exptl_crystal_density_diffrn    1.478
_exptl_crystal_description       plate
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_exptl_crystal_recrystallization_method self-assembly
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_refine_diff_density_max         0.755
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_refine_ls_extinction_method     'SHELXL-2014/7 (Sheldrick 2014'
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_refine_ls_number_parameters     1369
_refine_ls_number_reflns         22567
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.084
_refine_ls_R_factor_all          0.0906
_refine_ls_R_factor_gt           0.0499
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.0814P)^2^+4.3284P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1367
_refine_ls_wR_factor_ref         0.1693
_reflns_Friedel_coverage         0.000
_reflns_number_gt                15017
_reflns_number_total             22567
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            c6ta05102b2.cif
_cod_data_source_block           ZnMOFazo
_cod_original_cell_volume        5068(2)
_cod_database_code               7236339
_shelx_shelxl_version_number     2014/7
_shelx_res_checksum              94784
_shelx_hkl_checksum              95537