(6R)-6-[(1E)-1-Buten-1-Yl]-1,4-Cycloheptadien

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Properties Simple | Detailed

Formula C11H16
IUPAC Name (6r)-6-[(e)-but-1-enyl]cyclohepta-1,4-diene
Molecular Mass 148.245 g·mol−1
Heat of Formation 92.4 ± 16.7 kJ·mol−1
Dipole Moment 0.39 ± 1.08 D
Volume 216.69 Å 3
Surface Area 210.52 Å 2
HOMO Energy -9.39 ± 0.55 eV
LUMO Energy 0.72 ± eV
Point Group Symmetry C1
Synonyms
  • (6r)-6-[(e)-but-1-enyl]cyclohepta-1,4-diene
  • 1,4-cycloheptadiene, 6-(1-butenyl)-, (r-(z))-
  • 1-(1-butenyl)-2,5-cycloheptadiene
  • ectocarpene
CAS Number(s)
  • 33156-93-3
  • 52589-18-1
InChIKey KIFXGGYCNMHCSX-AEBAWRHJSA-N
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Elements H C