N-(3-Methyl-2-Pyridinyl)-1-{4-[(Trifluoromethyl)Sulfonyl]Phenyl}-1,2,3,6-Tetrahydro-4-Pyridinecarboxamide

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Properties Simple | Detailed

Formula C19H18F3N3O3S
IUPAC Name n-(3-methyl-2-pyridyl)-1-[4-(trifluoromethylsulfonyl)phenyl]-3,6-dihydro-2h-pyridine-4-carboxamide
Molecular Mass 425.425 g·mol−1
Heat of Formation -823.8 ± 16.7 kJ·mol−1
Dipole Moment 11.44 ± 1.08 D
Volume 457.42 Å 3
Surface Area 401.93 Å 2
HOMO Energy -8.99 ± 0.55 eV
LUMO Energy 2.36 ± eV
Point Group Symmetry C1
InChIKey KACDTVMXDRFPPA-UHFFFAOYSA-N
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