2-[(3S,5S,7S)-Adamantan-1-Yl]-1H-Benzimidazole

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Properties Simple | Detailed

Formula C17H20N2
IUPAC Name 2-(1-adamantyl)benzimidazol-1-ium-2-ylium
Molecular Mass 252.354 g·mol−1
Heat of Formation 102.0 ± 16.7 kJ·mol−1
Dipole Moment 3.64 ± 1.08 D
Volume 309.16 Å 3
Surface Area 270.19 Å 2
HOMO Energy -8.95 ± 0.55 eV
LUMO Energy 2.87 ± eV
Point Group Symmetry Cs
InChIKey VZJQLKDAEBGCCW-FBBPANFNSA-N
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Elements H C N