Formula |
C18H12F5N3O |
IUPAC Name |
3-(difluoromethyl)-1-methyl-n-[2-(3,4,5-trifluorophenyl)phenyl]pyrazol-1-ium-2-ide-4-carboxamide |
Molecular Mass |
381.299 g·mol−1 |
Heat of Formation |
-751.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.55 ± 1.08 D |
Volume |
399.29 Å 3 |
Surface Area |
353.4 Å 2 |
HOMO Energy |
-8.97 ± 0.55 eV |
LUMO Energy |
2.04 ± eV |
Point Group Symmetry |
Cs
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Synonyms
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- 3-(difluoromethyl)-1-methyl-n-[2-(3,4,5-trifluorophenyl)phenyl]-4-pyrazolecarboxamide
- 3-(difluoromethyl)-1-methyl-n-[2-(3,4,5-trifluorophenyl)phenyl]pyrazole-4-carboxamide
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InChIKey |
SXSGXWCSHSVPGB-UHFFFAOYSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
H
C
N
O
F
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