4-(1H-Indol-1-Ylmethyl)Benzenecarboximidamide

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Properties Simple | Detailed

Formula C16H15N3
IUPAC Name 4-(indol-1-ium-1-ylmethyl)benzamidine
Molecular Mass 249.310 g·mol−1
Heat of Formation 356.1 ± 16.7 kJ·mol−1
Dipole Moment 3.80 ± 1.08 D
Volume 310.2 Å 3
Surface Area 283.18 Å 2
HOMO Energy -8.49 ± 0.55 eV
LUMO Energy -0.39 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(4-amidinobenzyl)indole
  • 4-(1-indolylmethyl)benzamidine
  • 4-(indol-1-ylmethyl)benzamidine
  • 4-(indol-1-ylmethyl)benzenecarboximidamide
  • 4-abi
  • benzenecarboximidamide, 4-(1h-indol-1-ylmethyl)-
CAS Number(s)
  • 83783-25-9
InChIKey VKEKMIKRPJWXHO-UHFFFAOYSA-N
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Elements H C N