(1S,4S)-2-[3-(5-Methyl-1,3,4-Oxadiazol-2-Yl)-3,3-Diphenylpropyl]-2-Azabicyclo[2.2.2]Octane
Properties
Property | Value |
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Formula | C25H29N3O |
IUPAC Name | 2-[3-[(2r)-2-azabicyclo[2.2.2]octan-2-yl]-1,1-diphenyl-propyl]-5-methyl-1,3,4-oxadiazole |
Molecular Mass | 387.517 g·mol−1 |
Heat of Formation | 178.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.44 ± 1.08 D |
Volume | 490.18 Å 3 |
Surface Area | 384.85 Å 2 |
HOMO Energy | -8.59 ± 0.55 eV |
LUMO Energy | -0.10 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | CVOCKGAVXLCEGM-UHGJSFDGSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |