Formula |
C15H17ClF3NO2S |
IUPAC Name |
1-[4-[4-chloro-3-(trifluoromethyl)phenyl]-4-hydroxy-1-piperidyl]-3-sulfanyl-propan-1-one |
Molecular Mass |
367.814 g·mol−1 |
Heat of Formation |
-1042.8 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.40 ± 1.08 D |
Volume |
392.19 Å 3 |
Surface Area |
338.44 Å 2 |
HOMO Energy |
-9.13 ± 0.55 eV |
LUMO Energy |
1.84 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
STKPEUISNQZVRV-UHFFFAOYSA-N |
QR Code |
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Elements |
C
F
H
Cl
O
N
S
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