5H-Pyrrolo[1,2-A]Azepin-5-One

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Properties Simple | Detailed

Formula C9H7NO
IUPAC Name pyrrolo[1,2-a]azepin-5-one
Molecular Mass 145.158 g·mol−1
Heat of Formation 100.7 ± 16.7 kJ·mol−1
Dipole Moment 3.48 ± 1.08 D
Volume 172.6 Å 3
Surface Area 171.83 Å 2
HOMO Energy -8.86 ± 0.55 eV
LUMO Energy 1.82 ± eV
Point Group Symmetry Cs
Synonyms
  • 5-pyrrolo[2,1-g]azepinone
InChIKey HYYOGUONRBRYJQ-UHFFFAOYSA-N
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