(3S,5S,7S)-1-Adamantanecarbonitrile

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Properties Simple | Detailed

Formula C11H15N
IUPAC Name adamantane-1-carbonitrile
Molecular Mass 161.243 g·mol−1
Heat of Formation 3.4 ± 16.7 kJ·mol−1
Dipole Moment 4.23 ± 1.08 D
Volume 208.16 Å 3
Surface Area 188.4 Å 2
HOMO Energy -10.68 ± 0.55 eV
LUMO Energy 4.36 ± eV
Point Group Symmetry C3v
InChIKey FQFZASRJFRAEIH-BIBSGERRSA-N
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Elements H C N