(3E)-3-(5,6-Dihydro-11H-Pyrrolo[2,1-B][3]Benzazepin-11-Ylidene)-N,N-Dimethyl-1-Propanamine

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Formula C18H22N2
IUPAC Name (3e)-3-(5,6-dihydropyrrolo[1,2-c][3]benzazepin-11-ylidene)-n,n-dimethyl-propan-1-amine
Molecular Mass 266.381 g·mol−1
Heat of Formation 233.1 ± 16.7 kJ·mol−1
Dipole Moment 1.94 ± 1.08 D
Volume 349.86 Å 3
Surface Area 312.1 Å 2
HOMO Energy -8.33 ± 0.55 eV
LUMO Energy 0.05 ± eV
Point Group Symmetry C1
Synonyms
  • (3e)-3-(5,6-dihydropyrrolo[1,2-c][3]benzazepin-11-ylidene)-n,n-dimethyl-propan-1-amine
  • 1-propanamine, 3-(5,6-dihydro-11h-pyrrolo(2,1-b)(3)benzazepin-11-ylidene)-n,n-dimethyl-
  • 3-(9-chloro-6,11-dihydro-5h-pyrrolo(2,1-b)(3)benzazepin-11-ylidene)-n,n-dimethyl-1-propanamine
  • 3-cdpbdp
  • [(3e)-3-(5,6-dihydropyrrolo[1,2-c][3]benzazepin-11-ylidene)propyl]-dimethyl-amine
CAS Number(s)
  • 62541-85-9
InChIKey MBSORYCFRFFVBR-RQZCQDPDSA-N
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