4H-Thieno[3,2-B]Pyrrole-5-Carboxylic Acid

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Properties Simple | Detailed

Formula C7H5NO2S
IUPAC Name thieno[3,2-b]pyrrole-1,4-diium-5-carboxylic acid
Molecular Mass 167.185 g·mol−1
Heat of Formation -152.8 ± 16.7 kJ·mol−1
Dipole Moment 3.52 ± 1.08 D
Volume 177.63 Å 3
Surface Area 179.28 Å 2
HOMO Energy -8.67 ± 0.55 eV
LUMO Energy 2.13 ± eV
Point Group Symmetry Cs
Synonyms
  • 4h-thieno[2,3-d]pyrrole-5-carboxylic acid
  • cc 39001
InChIKey PMHDSACGRKBACK-UHFFFAOYSA-N
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