Functionalized nitronyl nitroxide biradical bridged one-dimensional lanthanide chains: slow magnetic relaxation in the Tb and Dy analogues
Li, Hongdao; Sun, Juan; Yang, Meng; Sun, Zan; Xie, Jing; Ma, Yue; Li, Licun; New J. Chem. 41 (2017) 10181–10188; doi:10.1039/C7NJ02006F

data_7056489
_publ_section_title
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 Functionalized nitronyl nitroxide biradical bridged one-dimensional
 lanthanide chains: slow magnetic relaxation in the Tb and Dy analogues
;
_journal_issue                   18
_journal_name_full               'New J. Chem.'
_journal_page_first              10181
_journal_page_last               10188
_journal_paper_doi               10.1039/C7NJ02006F
_journal_volume                  41
_journal_year                    2017
_chemical_formula_moiety         'C39 H44 Cl2 Dy F9 N6 O10'
_chemical_formula_sum            'C39 H44 Cl2 Dy F9 N6 O10'
_chemical_formula_weight         1161.20
_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'
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_audit_update_record
;
2017-07-21 deposited with the CCDC.
2017-08-02 downloaded from the CCDC.
;
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_computing_molecular_graphics    'Bruker SHELXTL'
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_computing_structure_solution    'SHELXL-2014/7 (Sheldrick, 2014)'
_diffrn_ambient_temperature      113(2)
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_diffrn_measured_fraction_theta_max 0.950
_diffrn_measurement_device_type  'CCD area detector'
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_exptl_absorpt_coefficient_mu    10.343
_exptl_absorpt_correction_T_max  0.214
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_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   CrystalClear
_exptl_crystal_colour            blue
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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^)+(0.1000P)^2^+7.0000P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1509
_refine_ls_wR_factor_ref         0.1538
_reflns_Friedel_coverage         0.000
_reflns_number_gt                8636
_reflns_number_total             9732
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            c7nj02006f2.cif
_cod_data_source_block           complex3
_cod_depositor_comments
;
The following automatic conversions were performed:

'_exptl_absorpt_correction_type' value 'Multi-scan' changed to
'multi-scan' according to
/home/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 4973 2017-02-22 13:04:09Z antanas 
;
_cod_database_code               7056489
_shelx_shelxl_version_number     2014/7
_shelx_res_checksum              62781
_shelx_fab_checksum              93748