N-(12-Cyanoindolizino[2,3-B]Quinoxaline-5,6,11-Triium-12-Id-2-Yl)-2H-Thiophen-1-Ium-2-Ylium-5-Carboxamide

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Formula C20H16N5OS+
IUPAC Name n-(12-cyanoindolizino[2,3-b]quinoxaline-5,6,11-triium-12-id-2-yl)-2h-thiophen-1-ium-2-ylium-5-carboxamide
Molecular Mass 374.439 g·mol−1
Heat of Formation 567.2 ± 16.7 kJ·mol−1
Dipole Moment 11.09 ± 1.08 D
Volume 403.59 Å 3
Surface Area 369.84 Å 2
HOMO Energy -8.52 ± 0.55 eV
LUMO Energy 0.30 ± eV
Point Group Symmetry C1
InChIKey ZBBNTVFGFGGZDU-UHFFFAOYSA-O
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