2-(5-Chloro-2-Thienyl)-N-{(3S)-1-[3-Fluoro-2'-(Methylsulfonyl)-4-Biphenylyl]-2-Oxo-3-Pyrrolidinyl}Ethanesulfonamide

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Properties Simple | Detailed

Formula C23H22ClFN2O5S3
IUPAC Name 2-(5-chloro-2-thienyl)-n-[(3s)-1-[2-fluoro-4-(2-methylsulfonylphenyl)phenyl]-2-oxo-pyrrolidin-3-yl]ethanesulfonamide
Molecular Mass 557.078 g·mol−1
Heat of Formation -751.3 ± 16.7 kJ·mol−1
Dipole Moment 7.08 ± 1.08 D
Volume 584.86 Å 3
Surface Area 489.44 Å 2
HOMO Energy -9.37 ± 0.55 eV
LUMO Energy 2.15 ± eV
Point Group Symmetry C1
InChIKey MRKBPFVJGAHTFU-IBGZPJMESA-N
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Elements C Cl H F O N S