Strong Solvent-Dependent Preference of Δ and Λ Stereoisomers of a Tris(diamine)nickel(II) Complex Revealed by Vibrational Circular Dichroism Spectroscopy.
Merten, Christian; McDonald, Robert; Xu, Yunjie; Inorganic chemistry 53 (2014) 3177–3182; doi:10.1021/ic4031766

data_4337685
_publ_section_title
;
 Strong Solvent-Dependent Preference of \D and \L Stereoisomers of a
 Tris(diamine)nickel(II) Complex Revealed by Vibrational Circular
 Dichroism Spectroscopy.
;
_journal_issue                   6
_journal_name_full               'Inorganic chemistry'
_journal_page_first              3177
_journal_page_last               3182
_journal_paper_doi               10.1021/ic4031766
_journal_volume                  53
_journal_year                    2014
_chemical_absolute_configuration ad
_chemical_formula_moiety         'C42 H48 N6 Ni, 2(Cl O4), 3(C2 H6 O S)'
_chemical_formula_sum            'C48 H66 Cl2 N6 Ni O11 S3'
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_chemical_name_systematic
; 
 ? 
;
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_refine_ls_abs_structure_details
; 
 Refined as an inversion twin. 
;
_refine_ls_abs_structure_Flack   0.020(17)
_refine_ls_extinction_method     none
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_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
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'w=1/[\s^2^(Fo^2^)+(0.0409P)^2^+4.8771P] where P=(Fo^2^+2Fc^2^)/3'
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