5-Nitroindole

Molecule SVG Image

Properties Simple | Detailed

Formula C8H6N2O2
IUPAC Name 5-nitro-7h-indol-1-ium-7-ide
Molecular Mass 162.145 g·mol−1
Heat of Formation 150.9 ± 16.7 kJ·mol−1
Dipole Moment 7.53 ± 1.08 D
Volume 178.27 Å 3
Surface Area 179.49 Å 2
HOMO Energy -9.40 ± 0.55 eV
LUMO Energy -1.09 ± eV
Point Group Symmetry Cs
Synonyms
  • 1h-indole, 5-nitro-
  • 1h-indole, 5-nitro- (9ci)
  • 5-nitro-1h-indole
  • indole, 5-nitro-
  • oprea1_492280
  • sb 01605
CAS Number(s)
  • 6146-52-7
InChIKey OZFPSOBLQZPIAV-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N