4,4-Dimethylpentanenitrile

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Properties Simple | Detailed

Formula C7H13N
IUPAC Name 4,4-dimethylpentanenitrile
Molecular Mass 111.185 g·mol−1
Heat of Formation -33.0 ± 16.7 kJ·mol−1
Dipole Moment 4.24 ± 1.08 D
Volume 172.23 Å 3
Surface Area 170.5 Å 2
HOMO Energy -11.63 ± 0.55 eV
LUMO Energy 4.27 ± eV
Point Group Symmetry Cs
Synonyms
  • 4,4-dimethylvaleronitrile
InChIKey VXVUDUCBEZFQGY-UHFFFAOYSA-N
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Elements H C N