(1S,2R,4As,8Ar)-1,2,5,5-Tetramethyl-1-{(3E)-3-Methyl-5-[(6Z)-3-Methyl-6-(Methylimino)-3,6-Dihydro-7H-Purin-7-Yl]-3-Penten-1-Yl}Octahydro-4A(2H)-Naphthalenol
Properties
| Property | Value |
|---|---|
| Formula | C27H43N5O |
| IUPAC Name | [7-[(e)-5-[(1s,2r,4as,8ar)-4a-hydroxy-1,2,5,5-tetramethyl-decalin-1-yl]-3-methyl-pent-2-enyl]-3-methyl-purine-1,9-diium-5-id-6-yl]-methyl-azanide |
| Molecular Mass | 453.663 g·mol−1 |
| Heat of Formation | 4036.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.49 ± 1.08 D |
| Volume | 437.3 Å 3 |
| Surface Area | 357.16 Å 2 |
| HOMO Energy | -8.46 ± 0.55 eV |
| LUMO Energy | -1.85 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | YVDWEKJDGYJOJU-XFSIKYNXSA-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 |