2-(2-Formyl-1H-Pyrrol-1-Yl)-3-Thiophenecarbonitrile

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Properties Simple | Detailed

Formula C10H6N2OS
IUPAC Name 2-(2-formylpyrrol-1-ium-2-ylium-1-yl)thiophen-1-ium-3-ide-3-carbonitrile
Molecular Mass 202.232 g·mol−1
Heat of Formation 278.7 ± 16.7 kJ·mol−1
Dipole Moment 4.25 ± 1.08 D
Volume 232.39 Å 3
Surface Area 211.4 Å 2
HOMO Energy -9.62 ± 0.55 eV
LUMO Energy 1.59 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(2-formyl-1-pyrrolyl)-3-thiophenecarbonitrile
  • 2-(2-formylpyrrol-1-yl)thiophene-3-carbonitrile
  • 2-(2-methanoylpyrrol-1-yl)thiophene-3-carbonitrile
InChIKey ZWMJYUWUEQVXIH-UHFFFAOYSA-N
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