Formula |
C24H25F4NOS |
IUPAC Name |
2-[1-[(3z)-3-[6-fluoro-2-(trifluoromethyl)thioxanthen-9-ylidene]propyl]-4-piperidyl]ethanol |
Molecular Mass |
451.520 g·mol−1 |
Heat of Formation |
-860.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.54 ± 1.08 D |
Volume |
515.33 Å 3 |
Surface Area |
434.99 Å 2 |
HOMO Energy |
-8.65 ± 0.55 eV |
LUMO Energy |
-1.07 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2-[1-[(3z)-3-[6-fluoro-2-(trifluoromethyl)-9-thioxanthenylidene]propyl]-4-piperidinyl]ethanol
- 2-[1-[(3z)-3-[6-fluoro-2-(trifluoromethyl)thioxanthen-9-ylidene]propyl]-4-piperidyl]ethanol
- 2-[1-[(3z)-3-[6-fluoro-2-(trifluoromethyl)thioxanthen-9-ylidene]propyl]piperidin-4-yl]ethanol
- 4-piperidineethanol, 1-(3-(6-fluoro-2-(trifluoromethyl)-9h-thioxanthen-9-ylidene)propyl)-, (z)-
- lu 12-331
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CAS Number(s) |
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InChIKey |
CCUOZZURYIZOKX-UYKKPYKBSA-N |
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Elements |
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