N-[4-(1H-Imidazol-5-Yl)Phenyl]-N'-(2-Methyl-2-Propanyl)Imidoformamide

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Properties Simple | Detailed

Formula C14H18N4
IUPAC Name n'-tert-butyl-n-(4-imidazol-3-ium-4-ylium-4-ylphenyl)formamidine
Molecular Mass 242.320 g·mol−1
Heat of Formation 238.6 ± 16.7 kJ·mol−1
Dipole Moment 7.43 ± 1.08 D
Volume 315.66 Å 3
Surface Area 292.26 Å 2
HOMO Energy -8.32 ± 0.55 eV
LUMO Energy 2.80 ± eV
Point Group Symmetry C1
Synonyms
  • da 4626
  • da-4626
  • methanimidamide, n-(1,1-dimethylethyl)-n'-(4-(1h-imidazol-4-yl)phenyl)-
  • n'-tert-butyl-n-[4-(3h-imidazol-4-yl)phenyl]formamidine
  • n'-tert-butyl-n-[4-(3h-imidazol-4-yl)phenyl]methanimidamide
CAS Number(s)
  • 83184-14-9
InChIKey KUEHILWIADUSSA-UHFFFAOYSA-N
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Elements H C N