Nicotinamide 1-Oxide

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Formula C6H6N2O2
IUPAC Name 1-oxidopiperidine-2,3,4,5,6-pentaide-3-carboxamide
Molecular Mass 138.124 g·mol−1
Heat of Formation -72.2 ± 16.7 kJ·mol−1
Dipole Moment 2.99 ± 1.08 D
Volume 155.82 Å 3
Surface Area 161.51 Å 2
HOMO Energy -9.41 ± 0.55 eV
LUMO Energy 1.80 ± eV
Point Group Symmetry C1
InChIKey USSFUVKEHXDAPM-UHFFFAOYSA-N
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