2-[Bis(Cyanomethyl)Phosphanyl]Acetonitrile

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Properties Simple | Detailed

Formula C6H6N3P
IUPAC Name 2-[bis(cyanomethyl)phosphanyl]acetonitrile
Molecular Mass 151.106 g·mol−1
Heat of Formation 350.6 ± 16.7 kJ·mol−1
Dipole Moment 4.02 ± 1.08 D
Volume 197.45 Å 3
Surface Area 193.53 Å 2
HOMO Energy -10.33 ± 0.55 eV
LUMO Energy 2.33 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[bis(cyanomethyl)phosphanyl]ethanenitrile
InChIKey IYMJVSRFWNTCQN-UHFFFAOYSA-N
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Elements P C H N