5-(4-Cyano-3-Methylphenyl)-2-[4-(3-Isopropyl-1,2,4-Oxadiazol-5-Yl)-1-Piperidinyl]Nicotinonitrile

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Formula C24H24N6O
IUPAC Name 5-(4-cyano-3-methyl-phenyl)-2-[4-(3-isopropyl-1,2,4-oxadiazol-5-yl)-1-piperidyl]pyridine-3-carbonitrile
Molecular Mass 412.487 g·mol−1
Heat of Formation 453.8 ± 16.7 kJ·mol−1
Dipole Moment 2.25 ± 1.08 D
Volume 505.75 Å 3
Surface Area 449.16 Å 2
HOMO Energy -9.13 ± 0.55 eV
LUMO Energy 0.81 ± eV
Point Group Symmetry C1
InChIKey TXALYVIWRLTFFP-UHFFFAOYSA-N
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