5-Bromo-2-Nitro-3H-Pyridin-1-Ium-3-Ide

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Properties Simple | Detailed

Formula C5H4BrN2O2
IUPAC Name 5-bromo-2-nitro-3h-pyridin-1-ium-3-ide
Molecular Mass 204.001 g·mol−1
Heat of Formation 171.8 ± 16.7 kJ·mol−1
Dipole Moment 4.76 ± 1.08 D
Volume 165.8 Å 3
Surface Area 168.66 Å 2
HOMO Energy -10.52 ± 0.55 eV
LUMO Energy 1.09 ± eV
Point Group Symmetry Cs
InChIKey VANAYVRISATQMD-UHFFFAOYSA-N
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Elements H C O Br N