4-[Bis(4-Cyanophenyl)-Hydroxy-Methyl]Benzonitrile

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Properties Simple | Detailed

Formula C22H13N3O
IUPAC Name 4-[bis(4-cyanophenyl)-hydroxy-methyl]benzonitrile
Molecular Mass 335.358 g·mol−1
Heat of Formation 496.6 ± 16.7 kJ·mol−1
Dipole Moment 2.88 ± 1.08 D
Volume 403.53 Å 3
Surface Area 356.41 Å 2
HOMO Energy -10.44 ± 0.55 eV
LUMO Energy 0.66 ± eV
Point Group Symmetry C1
InChIKey KXPKKUWZSWVEMW-UHFFFAOYSA-N
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