(1E)-N-[(4As,6Ar,6Bs,8Ar,12As,14Ar,14Bs)-11-Cyano-2,2,6A,6B,9,9,12A-Heptamethyl-10,14-Dioxo-1,3,4,5,6,6A,6B,7,8,8A,9,10,12A,14,14A,14B-Hexadecahydro-4A(2H)-Picenyl]-2,2-Difluoropropanimidic Acid
Properties
| Property | Value |
|---|---|
| Formula | C33H44F2N2O3 |
| IUPAC Name | n-[(4as,6ar,6bs,8ar,12as,14ar,14bs)-11-cyano-2,2,6a,6b,9,9,12a-heptamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicen-4a-yl]-2,2-difluoro-propanamide |
| Molecular Mass | 554.711 g·mol−1 |
| Heat of Formation | -973.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.95 ± 1.08 D |
| Volume | 676.23 Å 3 |
| Surface Area | 488.57 Å 2 |
| HOMO Energy | -10.05 ± 0.55 eV |
| LUMO Energy | 1.91 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | RJCWBNBKOKFWNY-IDPLTSGASA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C N O F |