3-{(3R)-3-Methyl-4-[(4-Methyladamantan-1-Yl)Carbonyl]-1-Piperazinyl}-2-Pyridinecarbonitrile
Properties
Property | Value |
---|---|
Formula | C23H30N4O |
IUPAC Name | 3-[(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 |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
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Elements | H C O N |