The first ternary Nd-MOF/GO/Fe<sub>3</sub>O<sub>4</sub> nanocomposite exhibiting an excellent photocatalytic performance for dye degradation.
Bai, Yuting; Zhang, Shuo; Feng, Sisi; Zhu, Miaoli; Ma, Shengqian; Dalton transactions (Cambridge, England : 2003) 49 (2020) 10745–10754; doi:10.1039/d0dt01648a

data_7704590
_publ_section_title
;
 The first ternary Nd-MOF/GO/Fe<sub>3</sub>O<sub>4</sub> nanocomposite
 exhibiting an excellent photocatalytic performance for dye degradation.
;
_journal_issue                   31
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              10745
_journal_page_last               10754
_journal_paper_doi               10.1039/d0dt01648a
_journal_volume                  49
_journal_year                    2020
_chemical_formula_sum            'C57 H39 N Nd2 O20'
_chemical_formula_weight         1346.37
_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   mixed
_audit_creation_method           SHELXL-2018/3
_audit_update_record
;
2019-10-31 deposited with the CCDC.	2020-06-02 downloaded from the CCDC.
;
_cell_angle_alpha                72.607(3)
_cell_angle_beta                 85.403(3)
_cell_angle_gamma                80.601(4)
_cell_formula_units_Z            1
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_cell_length_b                   13.6342(6)
_cell_length_c                   18.1214(6)
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_cell_measurement_temperature    173(2)
_cell_measurement_theta_max      69.6550
_cell_measurement_theta_min      4.8460
_cell_volume                     1278.17(9)
_computing_cell_refinement       'CrysAlisPro, Agilent Technologies'
_computing_data_collection       'CrysAlisPro, Agilent Technologies'
_computing_data_reduction        'CrysAlisPro, Agilent Technologies'
_computing_structure_refinement  'SHELXL-2018/3 (Sheldrick, 2018)'
_diffrn_ambient_temperature      173(2)
_diffrn_measured_fraction_theta_full 0.978
_diffrn_measured_fraction_theta_max 0.963
_diffrn_measurement_device_type  'SuperNova, Dual, Cu at zero, Eos'
_diffrn_measurement_method       '\w scans'
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54184
_diffrn_reflns_av_R_equivalents  0.0298
_diffrn_reflns_av_unetI/netI     0.0394
_diffrn_reflns_Laue_measured_fraction_full 0.978
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_diffrn_reflns_limit_h_max       6
_diffrn_reflns_limit_h_min       -6
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_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_number            10201
_diffrn_reflns_point_group_measured_fraction_full 0.978
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_diffrn_reflns_theta_full        67.684
_diffrn_reflns_theta_max         69.717
_diffrn_reflns_theta_min         3.637
_diffrn_source                   'SuperNova (Cu) X-ray Source'
_exptl_absorpt_coefficient_mu    16.039
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.27367
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'CrysAlisPro, Agilent Technologies'
_exptl_crystal_colour            purple
_exptl_crystal_density_diffrn    1.749
_exptl_crystal_description       bulk
_exptl_crystal_F_000             668
_exptl_crystal_size_max          0.150
_exptl_crystal_size_mid          0.100
_exptl_crystal_size_min          0.100
_refine_diff_density_max         1.671
_refine_diff_density_min         -0.672
_refine_diff_density_rms         0.121
_refine_ls_extinction_method     none
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_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
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_refine_ls_number_reflns         4649
_refine_ls_number_restraints     34
_refine_ls_restrained_S_all      1.057
_refine_ls_R_factor_all          0.0323
_refine_ls_R_factor_gt           0.0309
_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^)+(0.0601P)^2^+1.4073P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0900
_refine_ls_wR_factor_ref         0.0915
_reflns_Friedel_coverage         0.000
_reflns_number_gt                4474
_reflns_number_total             4649
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            d0dt01648a2.cif
_cod_data_source_block           BYT_Nd
_cod_depositor_comments          'Adding full bibliography for 7704590.cif.'
_cod_original_cell_volume        1278.18(9)
_cod_database_code               7704590
_shelx_shelxl_version_number     2018/3
_shelx_res_checksum              2197