7-Nitro-1H-Indole-2-Carboxylic Acid

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Properties Simple | Detailed

Formula C9H6N2O4
IUPAC Name 7-nitroindol-1-ium-2-carboxylic acid
Molecular Mass 206.155 g·mol−1
Heat of Formation -213.5 ± 16.7 kJ·mol−1
Dipole Moment 2.83 ± 1.08 D
Volume 211.72 Å 3
Surface Area 209.48 Å 2
HOMO Energy -9.70 ± 0.55 eV
LUMO Energy -1.79 ± eV
Point Group Symmetry Cs
Synonyms
  • 1h-indole-2-carboxylic acid, 7-nitro-
  • 7-nitroindole-2-carboxylic acid
  • dna base excision repair pathway inhibitor
  • indole-2-carboxylic acid, 7-nitro- (8ci)
  • km 09181
  • oprea1_439132
InChIKey BIUCOFQROHIAEO-UHFFFAOYSA-N
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