[5-(3-Thienyl)-1H-Tetrazol-1-Yl]Acetic Acid

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Formula C7H6N4O2S
IUPAC Name 2-[5-(3-thienyl)-3,4-diaza-1-azonia-2-azanidacyclopenta-3,5-dien-1-yl]acetic acid
Molecular Mass 210.213 g·mol−1
Heat of Formation 94.4 ± 16.7 kJ·mol−1
Dipole Moment 7.53 ± 1.08 D
Volume 223.75 Å 3
Surface Area 211.52 Å 2
HOMO Energy -9.54 ± 0.55 eV
LUMO Energy -1.24 ± eV
Point Group Symmetry C1
Synonyms
  • (5-(3-thienyl)tetrazol-1-yl)acetic acid
  • 1h-tetrazole-1-acetic acid, 5-(3-thienyl)-
  • 2-(5-thiophen-3-yl-1,2,3,4-tetrazol-1-yl)ethanoic acid
  • 2-(5-thiophen-3-yltetrazol-1-yl)acetic acid
  • 2-[5-(3-thienyl)-1-tetrazolyl]acetic acid
  • 2-[5-(3-thienyl)tetrazol-1-yl]acetic acid
  • 5-(3-thienyl)-1h-tetrazole-1-acetic acid
  • 5-(3-thienyl)tetrazol-1-ylacetic acid
CAS Number(s)
  • 134717-73-0
InChIKey DDVAZOPRCKAYOV-UHFFFAOYSA-N
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