S-1-Cyano-2-Hydroxy-3-Butene

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Properties Simple | Detailed

Formula C5H7NO
IUPAC Name (3s)-3-hydroxypent-4-enenitrile
Molecular Mass 97.115 g·mol−1
Heat of Formation -28.7 ± 16.7 kJ·mol−1
Dipole Moment 4.79 ± 1.08 D
Volume 134.79 Å 3
Surface Area 142.33 Å 2
HOMO Energy -10.68 ± 0.55 eV
LUMO Energy 3.50 ± eV
Point Group Symmetry C1
Synonyms
  • (
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  • 3
  • 4
  • d
  • e
  • h
  • i
  • l
  • n
  • o
  • p
  • r
  • s
  • t
  • x
  • y
InChIKey PBCLOVRWBLGJQA-RXMQYKEDSA-N
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Elements H C O N