(3α,5α,17Beta)-3-Hydroxyandrostane-17-Carbonitrile
Properties
Property | Value |
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Formula | C20H31NO |
IUPAC Name | (3r,5s,8r,9s,10s,13s,14s,17s)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1h-cyclopenta[a]phenanthrene-17-carbonitrile |
Molecular Mass | 301.466 g·mol−1 |
Heat of Formation | -317.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.49 ± 1.08 D |
Volume | 399.8 Å 3 |
Surface Area | 314.58 Å 2 |
HOMO Energy | -10.22 ± 0.55 eV |
LUMO Energy | 1.27 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | DVTDUTYENPZLFP-YBXIWKLVSA-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 |