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 | 4157.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.36 ± 1.08 D |
Volume | 448.19 Å 3 |
Surface Area | 352.66 Å 2 |
HOMO Energy | -8.55 ± 0.55 eV |
LUMO Energy | -2.59 ± eV |
Point Group Symmetry | C1 |
InChIKey | YVDWEKJDGYJOJU-AVQWXDCKSA-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 |