N-Benzyl-1-(1-Methyl-1H-Pyrrol-2-Yl)Methanamine

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Properties Simple | Detailed

Formula C13H16N2
IUPAC Name n-[(1-methylpyrrol-1-ium-2-ylium-2-yl)methyl]-1-phenyl-methanamine
Molecular Mass 200.280 g·mol−1
Heat of Formation 189.4 ± 16.7 kJ·mol−1
Dipole Moment 3.06 ± 1.08 D
Volume 267.07 Å 3
Surface Area 224.91 Å 2
HOMO Energy -8.53 ± 0.55 eV
LUMO Energy 0.27 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(1-methyl-2-pyrrolyl)-n-(phenylmethyl)methanamine
  • 1-(1-methylpyrrol-2-yl)-n-(phenylmethyl)methanamine
  • an-465/42767049
  • bas 10796078
  • benzyl-(1-methyl-1h-pyrrol-2-ylmethyl)-amine
  • benzyl-[(1-methylpyrrol-2-yl)methyl]amine
InChIKey RFBDIJWXYJNKSB-UHFFFAOYSA-N
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Elements H C N