N'-Acetyl-2-Chlorodibenzo[B,F][1,4]Oxazepine-10(11H)-Carbohydrazide

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Properties Simple | Detailed

Formula C16H14ClN3O3
IUPAC Name n'-acetyl-8-chloro-6h-benzo[b][1,4]benzoxazepine-5-carbohydrazide
Molecular Mass 331.754 g·mol−1
Heat of Formation -207.5 ± 16.7 kJ·mol−1
Dipole Moment 1.10 ± 1.08 D
Volume 359.51 Å 3
Surface Area 327.01 Å 2
HOMO Energy -8.90 ± 0.55 eV
LUMO Energy -0.64 ± eV
Point Group Symmetry C1
Synonyms
  • 8-chloro-n'-ethanoyl-6h-benzo[b][1,5]benzoxazepine-5-carbohydrazide
  • dibenz(b,f)(1,4)oxazepine-10(11h)-carboxylic acid, 8-chloro-, 2-acetylhydrazide
  • pdsp1_001724
  • pdsp2_001707
  • sc-19220
CAS Number(s)
  • 19395-87-0
InChIKey UETSVHKFTALXNP-UHFFFAOYSA-N
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Elements H C N O Cl