1-[1-(4-Methylphenyl)-3-(2-Methyl-2-Propanyl)-1H-Pyrazol-5-Yl]-3-[4-(3-Pyridinyl)Phenyl]Urea

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Properties Simple | Detailed

Formula C26H27N5O
IUPAC Name 1-[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]-3-[4-(3-pyridyl)phenyl]urea
Molecular Mass 425.525 g·mol−1
Heat of Formation 259.5 ± 16.7 kJ·mol−1
Dipole Moment 4.44 ± 1.08 D
Volume 523.19 Å 3
Surface Area 466.73 Å 2
HOMO Energy -8.81 ± 0.55 eV
LUMO Energy 2.49 ± eV
Point Group Symmetry C1
InChIKey JMQOIKOCLOMDPW-UHFFFAOYSA-N
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