4-{(2Z)-2-[(2Z,8Xi,9Xi,14Xi,16α,17Beta)-16,17-Dihydroxy-3-Oxoestra-1(10),4-Dien-2-Ylidene]Hydrazino}Benzoic Acid
Properties
| Property | Value |
|---|---|
| Formula | C25H28N2O5 |
| IUPAC Name | 4-[(2z)-2-[(8s,9r,13s,14r,16r,17r)-16,17-dihydroxy-13-methyl-3-oxo-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-2-ylidene]hydrazino]benzoic acid |
| Molecular Mass | 436.500 g·mol−1 |
| Heat of Formation | -682.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.98 ± 1.08 D |
| Volume | 507.54 Å 3 |
| Surface Area | 428.27 Å 2 |
| HOMO Energy | -8.78 ± 0.55 eV |
| LUMO Energy | -1.77 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | FKFCZCJDEVFWBA-FNGYZQJNSA-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 |