1-Cyano-3-[3-(1H-Imidazol-5-Yl)Propyl]-2-Methylguanidine

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Properties Simple | Detailed

Formula C9H14N6
IUPAC Name 1-cyano-3-(3-imidazol-3-ium-4-ylium-4-ylpropyl)-2-methyl-guanidine
Molecular Mass 206.248 g·mol−1
Heat of Formation 306.4 ± 16.7 kJ·mol−1
Dipole Moment 6.38 ± 1.08 D
Volume 264.78 Å 3
Surface Area 240.99 Å 2
HOMO Energy -9.09 ± 0.55 eV
LUMO Energy 0.13 ± eV
Point Group Symmetry C1
Synonyms
  • 3-cyano-1-[3-(3h-imidazol-4-yl)propyl]-2-methyl-guanidine
  • 3-cyano-1-[3-(3h-imidazol-4-yl)propyl]-2-methylguanidine
InChIKey CXTGREPICTYOGB-UHFFFAOYSA-N
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Elements H C N