N-(2-Chloroethyl)-N'-β-D-Glucopyranosyl-N-Nitrosourea
Properties
| Property | Value |
|---|---|
| Formula | C9H16ClN3O7 |
| IUPAC Name | 1-(2-chloroethyl)-1-nitroso-3-[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]urea |
| Molecular Mass | 313.692 g·mol−1 |
| Heat of Formation | -1114.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.45 ± 1.08 D |
| Volume | 336.33 Å 3 |
| Surface Area | 296.61 Å 2 |
| HOMO Energy | -10.44 ± 0.55 eV |
| LUMO Energy | -0.81 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | ZOBLZIKVIHJGRN-TVNFTVLESA-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 |