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_2312615
_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 H20 B N7, 0.14H2 O'
_chemical_formula_moiety         'C31 H20 B N7, 0.14(H2 O)'
_chemical_formula_sum            'C31 H20.28 B N7 O0.14'
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_chemical_name_systematic
;
(<i>N</i>-Phenylbenzamido)(subphthalocyaninato)boron
;
_space_group_crystal_system      triclinic
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_space_group_name_Hall           '-P 1'
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;
APEX4 (Bruker, 2021)
;
_computing_data_collection
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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_shift/su_mean         0.000
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'w=1/[\s^2^(Fo^2^)+(0.0453P)^2^+0.6870P] where P=(Fo^2^+2Fc^2^)/3'
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