S-23

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Properties Simple | Detailed

Formula C18H13ClF4N2O3
IUPAC Name (2s)-3-(4-chloro-3-fluoro-phenoxy)-n-[4-cyano-3-(trifluoromethyl)phenyl]-2-hydroxy-2-methyl-propanamide
Molecular Mass 416.754 g·mol−1
Heat of Formation -1122.5 ± 16.7 kJ·mol−1
Dipole Moment 5.35 ± 1.08 D
Volume 431.37 Å 3
Surface Area 387.88 Å 2
HOMO Energy -9.72 ± 0.55 eV
LUMO Energy 1.53 ± eV
Point Group Symmetry C1
InChIKey SSFVOEAXHZGTRJ-KRWDZBQOSA-N
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