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_2312604
_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'
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_journal_volume                  80
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_chemical_formula_iupac          'C26 H14 B F3 N6 O'
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_chemical_formula_sum            'C26 H14 B F3 N6 O'
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_chemical_name_systematic
;
(Subphthalocyaninato)(2,2,2-trifluoroethanolato)boron
;
_space_group_crystal_system      monoclinic
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;
APEX4 (Bruker, 2021)
;
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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_extinction_expression Fc^*^=kFc[1+0.001xFc^2^\l^3^/sin(2\q)]^-1/4^
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SHELXL2019 (Sheldrick, 2015<i>b</i>)
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'w=1/[\s^2^(Fo^2^)+(0.0593P)^2^+0.5694P] where P=(Fo^2^+2Fc^2^)/3'
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