2,2-Diphenyl-N-(2,2,2-Trichloro-1-{[(4-Fluoro-3-Nitrophenyl)Carbamothioyl]Amino}Ethyl)Acetamide

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Formula C23H18Cl3FN4O3S
IUPAC Name 2,2-diphenyl-n-[(1s)-2,2,2-trichloro-1-[(4-fluoro-3-nitro-phenyl)carbamothioylamino]ethyl]acetamide
Molecular Mass 555.836 g·mol−1
Heat of Formation -104.7 ± 16.7 kJ·mol−1
Dipole Moment 7.04 ± 1.08 D
Volume 577.24 Å 3
Surface Area 458.02 Å 2
HOMO Energy -9.12 ± 0.55 eV
LUMO Energy 1.25 ± eV
Point Group Symmetry C1
InChIKey HLCDNLNLQNYZTK-NRFANRHFSA-N
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Elements C F H Cl O N S