2-(2-Methyl-5-Nitro-1H-Imidazol-1-Yl)Ethyl [2,2,2-Trichloro-1-(2-Pyrimidinylamino)Ethyl]Carbamate
Properties
| Property | Value |
|---|---|
| Formula | C13H14Cl3N7O4 |
| IUPAC Name | 2-(2-methyl-5-nitro-imidazol-3-ium-5-id-1-yl)ethyl n-[(1r)-2,2,2-trichloro-1-(5h-pyrimidine-1,3-diium-5-id-2-ylamino)ethyl]carbamate |
| Molecular Mass | 438.654 g·mol−1 |
| Heat of Formation | -218.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.87 ± 1.08 D |
| Volume | 450.08 Å 3 |
| Surface Area | 344.04 Å 2 |
| HOMO Energy | -9.66 ± 0.55 eV |
| LUMO Energy | 2.00 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | ZEXHXVOGJFGTRX-SNVBAGLBSA-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 |