Ns-11394

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Properties Simple | Detailed

Formula C23H19N3O
IUPAC Name 2-[3-[5-(1-hydroxy-1-methyl-ethyl)benzimidazol-1-ium-1-yl]phenyl]benzonitrile
Molecular Mass 353.416 g·mol−1
Heat of Formation 298.0 ± 16.7 kJ·mol−1
Dipole Moment 5.88 ± 1.08 D
Volume 435.26 Å 3
Surface Area 375.16 Å 2
HOMO Energy -8.76 ± 0.55 eV
LUMO Energy 2.06 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[3-[5-(1-hydroxy-1-methyl-ethyl)benzimidazol-1-yl]phenyl]benzonitrile
  • 2-[3-[5-(1-hydroxy-1-methylethyl)-1-benzimidazolyl]phenyl]benzonitrile
  • 2-[3-[5-(2-hydroxypropan-2-yl)benzimidazol-1-yl]phenyl]benzonitrile
InChIKey HLKYSQGBIIIQJN-UHFFFAOYSA-N
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