5-[2-Chloro-4-(Trifluoromethyl)Phenoxy]-N-Methylsulfonyl-2-Nitro-Benzamide

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Properties Simple | Detailed

Formula C15H10ClF3N2O6S
IUPAC Name 5-[2-chloro-4-(trifluoromethyl)phenoxy]-n-methylsulfonyl-2-nitro-benzamide
Molecular Mass 438.763 g·mol−1
Heat of Formation -1199.1 ± 16.7 kJ·mol−1
Dipole Moment 4.70 ± 1.08 D
Volume 421.22 Å 3
Surface Area 363.5 Å 2
HOMO Energy -10.42 ± 0.55 eV
LUMO Energy -1.89 ± eV
Point Group Symmetry C1
InChIKey VDWKTXUAJRGFOR-UHFFFAOYSA-N
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Elements C F H Cl O N S