(1R,3R,4S)-4-[({6-[(4-Cyano-2-Fluorobenzyl)Oxy]-2-Naphthyl}Sulfonyl)Amino]-1,3-Cyclohexanedicarboxylic Acid
Properties
| Property | Value |
|---|---|
| Formula | C26H23FN2O7S |
| IUPAC Name | (1r,3r,4s)-4-[[6-[(4-cyano-2-fluoro-phenyl)methoxy]-2-naphthyl]sulfonylamino]cyclohexane-1,3-dicarboxylic acid |
| Molecular Mass | 526.533 g·mol−1 |
| Heat of Formation | -1115.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.02 ± 1.08 D |
| Volume | 579.61 Å 3 |
| Surface Area | 478.75 Å 2 |
| HOMO Energy | -9.17 ± 0.55 eV |
| LUMO Energy | -1.58 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | NYXJFBFDAFPUOG-XANCMCCPSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C F H O N S |