1-[(3S,5Z,7E)-25-Hydroxy-9,10-Secocholesta-5,7,10-Trien-3-Yl]-2Lambda~5~-1,2-Triazadien-2-Yl
Properties
Property | Value |
---|---|
Formula | C27H45N3O |
IUPAC Name | (6r)-6-[(1s,3as,4e,7ar)-4-[(2z)-2-[(5r)-5-azido-2-methylene-cyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1h-inden-1-yl]-2-methyl-heptan-2-ol |
Molecular Mass | 427.666 g·mol−1 |
Heat of Formation | -63.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.74 ± 1.08 D |
Volume | 589.88 Å 3 |
Surface Area | 460.08 Å 2 |
HOMO Energy | -8.60 ± 0.55 eV |
LUMO Energy | -0.26 ± eV |
Point Group Symmetry | C1 |
InChIKey | QUSNYFYPGGWUBY-LQHRJJHOSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |