1-(1-Phenylcyclohexyl)Azepane

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Properties Simple | Detailed

Formula C18H27N
IUPAC Name 1-(1-phenylcyclohexyl)azepane
Molecular Mass 257.414 g·mol−1
Heat of Formation 6.3 ± 16.7 kJ·mol−1
Dipole Moment 0.83 ± 1.08 D
Volume 345.98 Å 3
Surface Area 284.33 Å 2
HOMO Energy -8.23 ± 0.55 eV
LUMO Energy 0.29 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(1-phenylcyclohexyl)hexamethyleneimine
  • 1-pchhmi
  • 1h-azepine, hexahydro-1-(1-phenylcyclohexyl)-
CAS Number(s)
  • 2808-81-3
InChIKey VEDJSGPEAMLSIO-UHFFFAOYSA-N
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Elements H C N