1-Methyl-4-[(2E,4E)-6-Methyl-2,4-Heptadien-2-Yl]Cyclohexanecarbonitrile

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Properties Simple | Detailed

Formula C16H25N
IUPAC Name 4-[(1z,3e)-1,5-dimethylhexa-1,3-dienyl]-1-methyl-cyclohexanecarbonitrile
Molecular Mass 231.376 g·mol−1
Heat of Formation -11.5 ± 16.7 kJ·mol−1
Dipole Moment 3.77 ± 1.08 D
Volume 339.25 Å 3
Surface Area 287.5 Å 2
HOMO Energy -9.20 ± 0.55 eV
LUMO Energy 0.77 ± eV
Point Group Symmetry C1
InChIKey CJKGYZTWQDYRJY-IIFZKQRESA-N
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Elements H C N