2-Methoxy-3,3-Dimethylbutanenitrile

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Properties Simple | Detailed

Formula C7H13NO
IUPAC Name (2s)-2-methoxy-3,3-dimethyl-butanenitrile
Molecular Mass 127.184 g·mol−1
Heat of Formation -154.8 ± 16.7 kJ·mol−1
Dipole Moment 3.42 ± 1.08 D
Volume 183.32 Å 3
Surface Area 176.19 Å 2
HOMO Energy -10.59 ± 0.55 eV
LUMO Energy 0.89 ± eV
Point Group Symmetry C1
InChIKey TZWCUYWRLDRMCV-ZCFIWIBFSA-N
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