21-Diazonio-3-Oxopregna-4,20-Dien-20-Olate
Properties
Property | Value |
---|---|
Formula | C21H28N2O2 |
IUPAC Name | (z)-2-diazonio-1-[(8s,9s,10r,13s,14s,17s)-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]ethenolate |
Molecular Mass | 340.459 g·mol−1 |
Heat of Formation | -205.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.53 ± 1.08 D |
Volume | 428.33 Å 3 |
Surface Area | 342.84 Å 2 |
HOMO Energy | -9.79 ± 0.55 eV |
LUMO Energy | 2.44 ± eV |
Point Group Symmetry | C1 |
InChIKey | LCUJWGFEKPBUNF-YQRKQKOFSA-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 |