[Amino-[2-(5-Bromo-3-Methyl-6-Oxo-Cyclohexa-2,4-Dien-1-Yl)-6H-Indol-1-Ium-6-Id-5-Yl]Methylene]Ammonium

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Properties Simple | Detailed

Formula C16H15BrN3O
IUPAC Name [amino-[2-(5-bromo-3-methyl-6-oxo-cyclohexa-2,4-dien-1-yl)-6h-indol-1-ium-6-id-5-yl]methylene]ammonium
Molecular Mass 345.214 g·mol−1
Heat of Formation 267.3 ± 16.7 kJ·mol−1
Dipole Moment 24.05 ± 1.08 D
Volume 342.66 Å 3
Surface Area 316.82 Å 2
HOMO Energy -6.50 ± 0.55 eV
LUMO Energy -2.30 ± eV
Point Group Symmetry C1
InChIKey CRIIXKWSYIZGEY-UHFFFAOYSA-N
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Elements H C Br O N