7-Chloro-5-(2-Chlorophenyl)-2-Oxo-2,3-Dihydro-1H-1,4-Benzodiazepin-3-Yl β-D-Glucopyranosiduronic Acid
Properties
| Property | Value |
|---|---|
| Formula | C21H18Cl2N2O8 |
| IUPAC Name | (2s,3s,4s,5r,6s)-6-[[(3r)-7-chloro-5-(2-chlorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl]oxy]-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid |
| Molecular Mass | 497.282 g·mol−1 |
| Heat of Formation | -771.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.28 ± 1.08 D |
| Volume | 505.05 Å 3 |
| Surface Area | 380.37 Å 2 |
| HOMO Energy | -9.48 ± 0.55 eV |
| LUMO Energy | -1.27 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | IWOJSSFCRQKNKN-MDSWJYCDSA-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 |