N-[3-(10,11-Dihydro-5H-Dibenzo[B,F]Azepin-5-Yl)Propyl]-N-Methylacetamide

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Properties Simple | Detailed

Formula C20H24N2O
IUPAC Name n-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl]-n-methyl-acetamide
Molecular Mass 308.417 g·mol−1
Heat of Formation -43.5 ± 16.7 kJ·mol−1
Dipole Moment 4.64 ± 1.08 D
Volume 396.67 Å 3
Surface Area 320.04 Å 2
HOMO Energy -8.41 ± 0.55 eV
LUMO Energy 0.02 ± eV
Point Group Symmetry C1
Synonyms
  • desimipramine acetate
  • n-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl]-n-methyl-acetamide
  • n-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl]-n-methylacetamide
CAS Number(s)
  • 23047-26-9
InChIKey CNKJDYQMSWTPRH-UHFFFAOYSA-N
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