3-Chloro-4-({(2R)-4-[4-Fluoro-2-(Trifluoromethyl)Phenyl]-2-Methyl-1-Piperazinyl}Sulfonyl)Benzamide

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Formula C19H18ClF4N3O3S
IUPAC Name 3-chloro-4-[(1s,2r,4s)-4-[4-fluoro-2-(trifluoromethyl)phenyl]-2-methyl-piperazin-1-yl]sulfonyl-benzamide
Molecular Mass 479.876 g·mol−1
Heat of Formation -1183.5 ± 16.7 kJ·mol−1
Dipole Moment 6.09 ± 1.08 D
Volume 491.89 Å 3
Surface Area 394.65 Å 2
HOMO Energy -9.44 ± 0.55 eV
LUMO Energy -1.77 ± eV
Point Group Symmetry C1
InChIKey OMWNFYWEMXUREB-LLVKDONJSA-N
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Elements C F H Cl O N S