Nc2U2

Molecule SVG Image

Properties Simple | Detailed

Formula C5H7N
IUPAC Name (e)-pent-3-enenitrile
Molecular Mass 81.116 g·mol−1
Heat of Formation 116.4 ± 16.7 kJ·mol−1
Dipole Moment 4.24 ± 1.08 D
Volume 120.86 Å 3
Surface Area 136.79 Å 2
HOMO Energy -10.32 ± 0.55 eV
LUMO Energy 3.55 ± eV
Point Group Symmetry C1
Synonyms
  • (e)-pent-3-enenitrile
  • 3-pentenenitrile
  • 3-pentenenitrile, predominately trans
  • 3-pentenonitrile
  • fr-0047
  • pent-3-enenitrile
CAS Number(s)
  • 4635-87-4
InChIKey UVKXJAUUKPDDNW-NSCUHMNNSA-N
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DOI
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Elements H C N