1-{[2'-Hydroxy-3'-(1H-Pyrrolo[3,2-C]Pyridin-2-Yl)-3-Biphenylyl]Methyl}Urea

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Formula C21H18N4O2
IUPAC Name [3-(2-hydroxy-3-pyrrolo[3,2-c]pyridin-1-ium-3a-id-2-yl-phenyl)phenyl]methylurea
Molecular Mass 358.393 g·mol−1
Heat of Formation 20.5 ± 16.7 kJ·mol−1
Dipole Moment 2.60 ± 1.08 D
Volume 417.19 Å 3
Surface Area 378.91 Å 2
HOMO Energy -8.60 ± 0.55 eV
LUMO Energy 2.15 ± eV
Point Group Symmetry C1
Synonyms
  • 7nh
  • [3-[2-hydroxy-3-(1h-pyrrolo[4,5-c]pyridin-2-yl)phenyl]benzyl]urea
  • [3-[2-hydroxy-3-(1h-pyrrolo[4,5-c]pyridin-2-yl)phenyl]phenyl]methylurea
InChIKey SRPOHNDQBDHONJ-UHFFFAOYSA-N
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