N-{4-[Amino(Dihydroxy)-Lambda~4~-Sulfanyl]-2-Methylphenyl}-2-{4-Chloro-2-[3-Fluoro-5-(Trifluoromethyl)Benzoyl]Phenoxy}Acetamide

Molecule SVG Image

Properties Simple | Detailed

Formula C23H19ClF4N2O5S
IUPAC Name n-{4-[amino(dihydroxy)-lambda 4 -sulfanyl]-2-methylphenyl}-2-{4-chloro-2-[3-fluoro-5-(trifluoromethyl)benzoyl]phenoxy}acetamide
Molecular Mass 546.919 g·mol−1
Heat of Formation -1415.8 ± 16.7 kJ·mol−1
Dipole Moment 3.93 ± 1.08 D
Volume 559.41 Å 3
Surface Area 402.59 Å 2
HOMO Energy -8.17 ± 0.55 eV
LUMO Energy 1.86 ± eV
Point Group Symmetry C1
InChIKey RXLXGVALXIAUEE-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements C F H Cl O N S