(4R)-4-[(2-Chloro-4-{[(2S)-1,1,1-Trifluoro-2-Propanyl]Oxy}Phenyl)Sulfonyl]-N-[1-(Iminomethyl)Cyclopropyl]-1-{[1-(Trifluoromethyl)Cyclopropyl]Carbonyl}-L-Prolinamide
Properties
Property | Value |
---|---|
Formula | C23H24ClF6N3O5S |
IUPAC Name | (2s,4r)-4-[2-chloro-4-[(1s)-2,2,2-trifluoro-1-methyl-ethoxy]phenyl]sulfonyl-n-(1-methanimidoylcyclopropyl)-1-[1-(trifluoromethyl)cyclopropanecarbonyl]pyrrolidine-2-carboxamide |
Molecular Mass | 603.962 g·mol−1 |
Heat of Formation | -1881.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.24 ± 1.08 D |
Volume | 624.23 Å 3 |
Surface Area | 464.59 Å 2 |
HOMO Energy | -9.82 ± 0.55 eV |
LUMO Energy | -1.61 ± eV |
Point Group Symmetry | C1 |
InChIKey | FXRUMLCPKBCVCA-YDWYZIHQSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | C Cl H F O N S |