5-(3-Hydroxyandrost-5-En-17-Yl)-1,2-Dihydro-3H-Pyrazol-3-One
Properties
| Property | Value |
|---|---|
| Formula | C22H32N2O2 |
| IUPAC Name | 5-[(3s,8s,9s,10r,13s,14s,17s)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1h-cyclopenta[a]phenanthren-17-yl]pyrazole-1,2-diium-3-one |
| Molecular Mass | 356.502 g·mol−1 |
| Heat of Formation | -331.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.31 ± 1.08 D |
| Volume | 451.12 Å 3 |
| Surface Area | 356.45 Å 2 |
| HOMO Energy | -9.27 ± 0.55 eV |
| LUMO Energy | -0.13 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | YDWCDXCQJNWYNH-LUTUCUKNSA-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 |