1-(3,5-Dichlorophenyl)-3-[4-(1H-Imidazol-5-Ylmethyl)Benzyl]Urea

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Properties Simple | Detailed

Formula C18H16Cl2N4O
IUPAC Name 1-(3,5-dichlorophenyl)-3-[[4-(imidazol-3-ium-4-ylium-4-ylmethyl)phenyl]methyl]urea
Molecular Mass 375.252 g·mol−1
Heat of Formation 53.0 ± 16.7 kJ·mol−1
Dipole Moment 8.49 ± 1.08 D
Volume 421.02 Å 3
Surface Area 382.02 Å 2
HOMO Energy -9.31 ± 0.55 eV
LUMO Energy -0.55 ± eV
Point Group Symmetry C1
Synonyms
  • 3-(3,5-dichlorophenyl)-1-[4-(3h-imidazol-4-ylmethyl)benzyl]urea
  • 3-(3,5-dichlorophenyl)-1-[[4-(3h-imidazol-4-ylmethyl)phenyl]methyl]urea
  • pdsp1_001301
  • pdsp2_001285
InChIKey CXNCQFJNXQAFND-UHFFFAOYSA-N
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Elements H C N O Cl