2,3,4,5-Tetrahydro-1H-(1,4)Diazepino(1,7-A)Indole

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Properties Simple | Detailed

Formula C12H14N2
IUPAC Name 2,3,4,5-tetrahydro-1h-[1,4]diazepino[1,7-a]indole
Molecular Mass 186.253 g·mol−1
Heat of Formation 184.7 ± 16.7 kJ·mol−1
Dipole Moment 3.29 ± 1.08 D
Volume 233.59 Å 3
Surface Area 216.99 Å 2
HOMO Energy -8.23 ± 0.55 eV
LUMO Energy 3.19 ± eV
Point Group Symmetry C1
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InChIKey XORPZYQOYUSNCQ-UHFFFAOYSA-N
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Elements H C N