4-(6-Bromo-8H-[1,2,4]Triazolo[4,3-A]Pyridin-4-Ium-8-Id-3-Yl)-6-Chloro-Benzene-1,3-Diol

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Formula C12H8BrClN3O2+
IUPAC Name 4-(6-bromo-8h-[1,2,4]triazolo[4,3-a]pyridin-4-ium-8-id-3-yl)-6-chloro-benzene-1,3-diol
Molecular Mass 341.568 g·mol−1
Heat of Formation 27.5 ± 16.7 kJ·mol−1
Dipole Moment 4.55 ± 1.08 D
Volume 300.7 Å 3
Surface Area 277.79 Å 2
HOMO Energy -9.10 ± 0.55 eV
LUMO Energy -1.77 ± eV
Point Group Symmetry C1
InChIKey WIBYNAQEVLABKZ-UHFFFAOYSA-O
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Elements C Cl H O N Br