(S)-Mandelonitrile

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Properties Simple | Detailed

Formula C8H7NO
IUPAC Name (2s)-2-hydroxy-2-phenyl-acetonitrile
Molecular Mass 133.147 g·mol−1
Heat of Formation 42.9 ± 16.7 kJ·mol−1
Dipole Moment 3.48 ± 1.08 D
Volume 167.29 Å 3
Surface Area 170.36 Å 2
HOMO Energy -10.26 ± 0.55 eV
LUMO Energy -0.74 ± eV
Point Group Symmetry C1
Synonyms
  • (-)-mandelonitrile
  • (2s)-2-hydroxy-2-phenyl-acetonitrile
  • (2s)-2-hydroxy-2-phenyl-ethanenitrile
  • (2s)-2-hydroxy-2-phenylacetonitrile
  • (2s)-hydroxy(phenyl)acetonitrile
  • (s)-(-)-mandelonitrile
  • (s)-benzaldehyde cyanohydrin
  • (s)-hydroxy(phenyl)acetonitrile
  • (s)-mandelic acid nitrile
  • l-mandelonitrile
  • mnn
InChIKey NNICRUQPODTGRU-MRVPVSSYSA-N
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