5-Amino-1-(2,6-Dichloro-A,A,A-Trifluoro-P-Tolyl)-4-Ethylsulfinylpyrazole-3-Carbonitrile

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Formula C13H9Cl2F3N4OS
IUPAC Name 5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-[(r)-ethylsulfinyl]pyrazole-3-carbonitrile
Molecular Mass 397.203 g·mol−1
Heat of Formation -426.7 ± 16.7 kJ·mol−1
Dipole Moment 3.35 ± 1.08 D
Volume 394.21 Å 3
Surface Area 338.03 Å 2
HOMO Energy -8.72 ± 0.55 eV
LUMO Energy -1.95 ± eV
Point Group Symmetry C1
InChIKey FNELVJVBIYMIMC-XMMPIXPASA-N
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