Half-sandwich lanthanide crown ether complexes with the slow relaxation of magnetization and photoluminescence behaviors.
Gao, Feng; Yang, Feng-Lei; Feng, Xiaowan; Xu, Huimin; Sun, Wang; Liu, Huan; Li, Xiu-Ling; Dalton transactions (Cambridge, England : 2003) 46 (2017) 1317–1323; doi:10.1039/c6dt04353d

data_7041529
_publ_section_title
;
 Half-sandwich lanthanide crown ether complexes with the slow relaxation
 of magnetization and photoluminescence behaviors.
;
_journal_issue                   4
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              1317
_journal_page_last               1323
_journal_paper_doi               10.1039/c6dt04353d
_journal_volume                  46
_journal_year                    2017
_chemical_formula_sum            'C8 H16 Ho N3 O13'
_chemical_formula_weight         527.17
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2ybc'
_space_group_name_H-M_alt        'P 1 21/c 1'
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2016/6
_audit_update_record
;
2016-12-02 deposited with the CCDC.
2016-12-21 downloaded from the CCDC.
;
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_cell_length_c                   15.0895(9)
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_cell_measurement_temperature    123(2)
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_cell_measurement_theta_min      2.75
_cell_volume                     1527.14(16)
_computing_cell_refinement       'Bruker SMART'
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_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-2016/6 (Sheldrick, 2016)'
_computing_structure_solution    'Bruker SHELXTL'
_diffrn_ambient_temperature      123(2)
_diffrn_measured_fraction_theta_full 0.996
_diffrn_measured_fraction_theta_max 0.984
_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  0.0201
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_diffrn_reflns_Laue_measured_fraction_full 0.996
_diffrn_reflns_Laue_measured_fraction_max 0.984
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_diffrn_reflns_limit_l_min       -17
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_diffrn_reflns_point_group_measured_fraction_full 0.996
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_exptl_absorpt_coefficient_mu    5.260
_exptl_absorpt_correction_T_max  0.6489
_exptl_absorpt_correction_T_min  0.5709
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS (Bruker, 2011)'
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_refine_ls_R_factor_all          0.0230
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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^)+(0.0158P)^2^+1.2257P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0429
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_reflns_number_gt                3204
_reflns_number_total             3417
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            c6dt04353d2.cif
_cod_data_source_block           3
_cod_depositor_comments
'Adding full bibliography for 7041526--7041529.cif.'
_cod_database_code               7041529
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