1-[1-(4-Fluorophenyl)-2,5-Dimethyl-1H-Pyrrol-3-Yl]-2-(1-Pyrrolidinyl)Ethanone

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Formula C18H21FN2O
IUPAC Name 1-[1-(4-fluorophenyl)-2,5-dimethyl-pyrrol-1-ium-2-ylium-3-yl]-2-pyrrolidin-1-yl-ethanone
Molecular Mass 300.371 g·mol−1
Heat of Formation -192.2 ± 16.7 kJ·mol−1
Dipole Moment 3.78 ± 1.08 D
Volume 370.21 Å 3
Surface Area 329.76 Å 2
HOMO Energy -8.70 ± 0.55 eV
LUMO Energy 2.31 ± eV
Point Group Symmetry C1
Synonyms
  • 1-[1-(4-fluorophenyl)-2,5-dimethyl-3-pyrrolyl]-2-1-pyrrolidinylethanone
  • 1-[1-(4-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-pyrrolidin-1-yl-ethanone
  • 1-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-pyrrolidin-1-ylethanone
InChIKey JUWDSDKJBMFLHE-UHFFFAOYSA-N
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