The influence of the axial group on the crystal structures of boron subphthalocyanines.
Zigelstein, Rachel; Lough, Alan J.; Bender, Timothy P.; Acta crystallographica. Section C, Structural chemistry 80 (2024) –; doi:10.1107/S2053229624006934

data_2312611
_publ_section_title
;
 The influence of the axial group on the crystal structures of boron
 subphthalocyanines.
;
_journal_coeditor_code           DG3059
_journal_issue                   10
_journal_name_full
'Acta crystallographica. Section C, Structural chemistry'
_journal_paper_doi               10.1107/S2053229624006934
_journal_volume                  80
_journal_year                    2024
_chemical_formula_iupac          'C31 H17 B N6 O2'
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_chemical_formula_sum            'C31 H17 B N6 O2'
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_chemical_name_systematic
;
(Benzoato)(subphthalocyaninato)boron
;
_space_group_crystal_system      monoclinic
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;
APEX4 (Bruker, 2021)
;
_computing_data_collection
;
APEX4 (Bruker, 2021)
;
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APEX4 (Bruker, 2021)
;
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;
PLATON (Spek, 2020)
;
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SHELXTL (Sheldrick, 2008)
;
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SHELXL2019 (Sheldrick, 2015<i>b</i>)
;
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;
SHELXT2018 (Sheldrick, 2015<i>a</i>)
;
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;
(SADABS; Krause <i>et al.</i>,  2015)
;
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_refine_ls_structure_factor_coef Fsqd
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'w=1/[\s^2^(Fo^2^)+(0.0424P)^2^+0.5643P] where P=(Fo^2^+2Fc^2^)/3'
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