A,A,A-Trifluoro-2,6-Dimethylthio-1-Piperidinecarboxy-M-Toluidide

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Properties Simple | Detailed

Formula C15H19F3N2S
IUPAC Name (2r,6r)-2,6-dimethyl-n-[3-(trifluoromethyl)phenyl]piperidine-1-carbothioamide
Molecular Mass 316.385 g·mol−1
Heat of Formation -569.8 ± 16.7 kJ·mol−1
Dipole Moment 8.88 ± 1.08 D
Volume 365.46 Å 3
Surface Area 312.7 Å 2
HOMO Energy -8.19 ± 0.55 eV
LUMO Energy -0.63 ± eV
Point Group Symmetry C1
InChIKey YTNJAWMNFLIDLW-GHMZBOCLSA-N
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Elements H S N C F