5H-Dibenz(B,F)Azepine-5-Propanamine, 10,11-Dihydro-N,N-Dimethyl-2-Nitro-

Molecule SVG Image

Properties Simple | Detailed

Formula C19H23N3O2
IUPAC Name n,n-dimethyl-3-(3-nitro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)propan-1-amine
Molecular Mass 325.405 g·mol−1
Heat of Formation 146.2 ± 16.7 kJ·mol−1
Dipole Moment 6.29 ± 1.08 D
Volume 398.6 Å 3
Surface Area 326.29 Å 2
HOMO Energy -8.37 ± 0.55 eV
LUMO Energy -1.07 ± eV
Point Group Symmetry C1
Synonyms
  • 2-nitroimipramine
  • dimethyl-[3-(8-nitro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl]amine
  • n,n-dimethyl-3-(8-nitro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)propan-1-amine
CAS Number(s)
  • 77533-92-7
InChIKey JYLKYRDTRZHXAJ-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N