X-ray studies of three 3,6-bis(pyridin-2-yl)-1,2,4,5-tetrazine cocrystals: an unexpected molecular conformation stabilized by hydrogen bonds.
Wzgarda-Raj, Kinga; Dominikowska, Justyna; Wojtulewski, Sławomir; Rybarczyk-Pirek, Agnieszka J; Acta crystallographica. Section C, Structural chemistry 79 (2023) 52–60; doi:10.1107/S2053229622012256

data_2312672
_publ_section_title
;
 X-ray studies of three 3,6-bis(pyridin-2-yl)-1,2,4,5-tetrazine
 cocrystals: an unexpected molecular conformation stabilized by hydrogen
 bonds.
;
_journal_coeditor_code           DG3037
_journal_issue                   'Pt 2'
_journal_name_full
'Acta crystallographica. Section C, Structural chemistry'
_journal_page_first              52
_journal_page_last               60
_journal_paper_doi               10.1107/S2053229622012256
_journal_volume                  79
_journal_year                    2023
_chemical_formula_iupac          'C12 H8 N6, C6 H6 N2 O4 S'
_chemical_formula_moiety         'C12 H8 N6, C6 H6 N2 O4 S'
_chemical_formula_sum            'C18 H14 N8 O4 S'
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;
3,6-Bis(pyridin-2-yl)-1,2,4,5-tetrazine--4-nitrobenzenesulfonamide (1/1)
;
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SHELXL2018 (Sheldrick, 2015<i>b</i>)
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SHELXT2018 (Sheldrick, 2015<i>a</i>)
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Rigaku OD SuperNova (Dual, Cu at home/near) diffractometer with an Atlas
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;
(CrysAlis PRO; Rigaku OD, 2015)
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'w=1/[\s^2^(Fo^2^)+(0.1143P)^2^+0.6984P] where P=(Fo^2^+2Fc^2^)/3'
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