10,11-Trans-Dihydroxy-10,11-Dihydrocarbamazepine

Molecule SVG Image

Properties Simple | Detailed

Formula C15H14N2O3
IUPAC Name (5s,6s)-5,6-dihydroxy-5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide
Molecular Mass 270.283 g·mol−1
Heat of Formation -339.7 ± 16.7 kJ·mol−1
Dipole Moment 3.52 ± 1.08 D
Volume 306.16 Å 3
Surface Area 263.58 Å 2
HOMO Energy -9.28 ± 0.55 eV
LUMO Energy -0.41 ± eV
Point Group Symmetry C1
Synonyms
  • (5s,6s)-5,6-dihydroxy-5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide
  • 5h-dibenz(b,f)azepine-5-carboxamide, 10,11-dihydro-10,11-dihydroxy-, (10r,11r)-rel-
  • 5h-dibenz(b,f)azepine-5-carboxamide, 10,11-dihydro-10,11-dihydroxy-, trans-
  • trans-10,11-dihydro-10,11-dihydroxy-5h-dibenz(b,f)azepine-5-carboxamide
  • trans-10,11-dihydroxy-10,11-dihydrocarbazepine
CAS Number(s)
  • 58955-93-4
InChIKey PRGQOPPDPVELEG-KBPBESRZSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N