1-O-{[(1S,4S)-4-(3,4-Dichlorophenyl)-1,2,3,4-Tetrahydro-1-Naphthalenyl](Methyl)Carbamoyl}Hexopyranuronic Acid
Properties
| Property | Value |
|---|---|
| Formula | C24H25Cl2NO8 |
| IUPAC Name | (2s,3s,4r,5r,6r)-6-[[(1s,4s)-4-(3,4-dichlorophenyl)tetralin-1-yl]-methyl-carbamoyl]oxy-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid |
| Molecular Mass | 526.363 g·mol−1 |
| Heat of Formation | -1412.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.38 ± 1.08 D |
| Volume | 565.24 Å 3 |
| Surface Area | 430.88 Å 2 |
| HOMO Energy | -9.79 ± 0.55 eV |
| LUMO Energy | -0.72 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | IFPBIAXQORQOIY-ATZUESPRSA-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 |