Disorder-Order Transformation and Significant Dislocation Motion Cooperating with a Surprisingly Large Hysteretic Magnetic Transition in a Nickel-Bisdithiolene Spin System
Hai-Bao Duan; Xuan-Rong Chen; Hao Yang; Xiao-Ming Ren; Fang Xuan; Shi-Ming Zhou; Inorganic Chemistry 52 (2013) 3870–3877; doi:10.1021/ic302571p

data_4334309
_publ_section_title
;
 Disorder-Order Transformation and Significant Dislocation Motion
 Cooperating with a Surprisingly Large Hysteretic Magnetic Transition in a
 Nickel-Bisdithiolene Spin System
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              3870
_journal_page_last               3877
_journal_paper_doi               10.1021/ic302571p
_journal_volume                  52
_journal_year                    2013
_chemical_formula_sum            'C21 H11 F3 N5 Ni S4'
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_chemical_name_systematic
; 
 ? 
;
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_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
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_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.987
_diffrn_measured_fraction_theta_max 0.987
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_diffrn_reflns_limit_k_min       -12
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_refine_ls_extinction_method     none
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_refine_ls_number_reflns         4716
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_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[\s^2^(Fo^2^)+(0.0757P)^2^+0.0000P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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