Coordination-Induced Spin-State Switching with Nickel Chlorin and Nickel Isobacteriochlorin.
Dommaschk, Marcel; Thoms, Vanessa; Schütt, Christian; Näther, Christian; Puttreddy, Rakesh; Rissanen, Kari; Herges, Rainer; Inorganic chemistry 54 (2015) 9390–9392; doi:10.1021/acs.inorgchem.5b01756

data_4344152
_publ_section_title
;
 Coordination-Induced Spin-State Switching with Nickel Chlorin and Nickel
 Isobacteriochlorin.
;
_journal_issue                   19
_journal_name_full               'Inorganic chemistry'
_journal_page_first              9390
_journal_page_last               9392
_journal_paper_doi               10.1021/acs.inorgchem.5b01756
_journal_volume                  54
_journal_year                    2015
_chemical_formula_sum            'C60 H32 F20 N8 Ni'
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_chemical_name_systematic
;
 ?
;
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_diffrn_ambient_temperature      170(2)
_diffrn_measured_fraction_theta_full 0.966
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_diffrn_measurement_device_type  'IPDS-2 (STOE & CIE)'
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_diffrn_radiation_type           MoK\a
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_diffrn_reflns_theta_max         25.004
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_exptl_absorpt_coefficient_mu    0.426
_exptl_absorpt_correction_type   none
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_exptl_crystal_description       block
_exptl_crystal_F_000             1968
_exptl_crystal_size_max          0.3
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_platon_squeeze_details
;
;
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_refine_ls_restrained_S_all      0.940
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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^)+(0.0774P)^2^] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_reflns_threshold_expression     'I > 2\s(I)'
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_cod_depositor_comments
'Adding full bibliography for 4344148--4344152.cif.'
_cod_database_code               4344152
_shelxl_version_number           2014-3
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