3-{(3R)-3-Methyl-4-[(4-Methyladamantan-1-Yl)Carbonyl]-1-Piperazinyl}-2-Pyridinecarbonitrile

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Formula C23H30N4O
IUPAC Name 3-[(1r,3r)-3-methyl-4-[(3s,5r)-4-methyladamantane-1-carbonyl]piperazin-1-yl]pyridine-2-carbonitrile
Molecular Mass 378.511 g·mol−1
Heat of Formation 7.2 ± 16.7 kJ·mol−1
Dipole Moment 6.24 ± 1.08 D
Volume 466.48 Å 3
Surface Area 376.44 Å 2
HOMO Energy -8.81 ± 0.55 eV
LUMO Energy 2.12 ± eV
Point Group Symmetry C1
InChIKey HPOKCTFUFZGTGF-YXVFRVAKSA-N
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