5-Phenyl-1,3-Dihydro-2H-1,4-Benzodiazepin-2-One

Molecule SVG Image

Properties Simple | Detailed

Formula C15H12N2O
IUPAC Name 5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one
Molecular Mass 236.269 g·mol−1
Heat of Formation 126.7 ± 16.7 kJ·mol−1
Dipole Moment 5.03 ± 1.08 D
Volume 280.9 Å 3
Surface Area 255.69 Å 2
HOMO Energy -9.31 ± 0.55 eV
LUMO Energy 2.28 ± eV
Point Group Symmetry C1
Synonyms
  • 1,3-dihydro-5-phenyl-2h-1,4-benzodiazepin-2-one
  • 2,3-dihydro-5-phenyl-1h-1,4-benzodiazepin-2-one
  • 2h-1,4-benzodiazepin-2-one, 1,3-dihydro-5-phenyl-
  • 5-phenyl-1,3-dihydro-benzo[e][1,4]diazepin-2-one
  • 5-phenyl-1,4-benzodiazepin-2-one
  • bas 03296478
  • ms-3038
  • oprea1_710885
CAS Number(s)
  • 2898-08-0
InChIKey IVUAAOBNUNMJQC-UHFFFAOYSA-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