5-[2-(1-{1-[(2-Hydroxy-2-Methylpropyl)Amino]-2-Propanyl}-7A-Methyloctahydro-4H-Inden-4-Ylidene)Ethylidene]-4-Methylene-1,3-Cyclohexanediol
Properties
Property | Value |
---|---|
Formula | C26H43NO3 |
IUPAC Name | (1r,3s,5z)-5-[(2e)-2-[(1r,3as,7ar)-1-[(1s)-2-[(2-hydroxy-2-methyl-propyl)amino]-1-methyl-ethyl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1h-inden-4-ylidene]ethylidene]-4-methylene-cyclohexane-1,3-diol |
Molecular Mass | 417.625 g·mol−1 |
Heat of Formation | -684.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.31 ± 1.08 D |
Volume | 561.95 Å 3 |
Surface Area | 455.18 Å 2 |
HOMO Energy | -8.64 ± 0.55 eV |
LUMO Energy | -0.06 ± eV |
Point Group Symmetry | C1 |
InChIKey | KJDVMNDTGSVQOU-ZNXWMXANSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |