(17β)-3-Oxoestr-4-En-17-Yl (2-Chloroethyl)Nitrosocarbamate
Properties
| Property | Value |
|---|---|
| Formula | C21H29ClN2O4 |
| IUPAC Name | [(8r,9s,10r,13s,14r,17s)-13-methyl-3-oxo-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1h-cyclopenta[a]phenanthren-17-yl] n-(2-chloroethyl)-n-nitroso-carbamate |
| Molecular Mass | 408.919 g·mol−1 |
| Heat of Formation | -646.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.57 ± 1.08 D |
| Volume | 482.48 Å 3 |
| Surface Area | 397.21 Å 2 |
| HOMO Energy | -9.87 ± 0.55 eV |
| LUMO Energy | -0.70 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KTQUNVRSLAGBSY-DLHQSYQFSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C N O Cl |