Formula |
C6H5NO2S |
IUPAC Name |
6-thioxo-1h-pyridine-3-carboxylic acid |
Molecular Mass |
155.174 g·mol−1 |
Heat of Formation |
-206.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.91 ± 1.08 D |
Volume |
169.62 Å 3 |
Surface Area |
172.3 Å 2 |
HOMO Energy |
-8.76 ± 0.55 eV |
LUMO Energy |
-1.79 ± eV |
Point Group Symmetry |
Cs
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Synonyms
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- 1,6-dihydro-6-thioxonicotinic acid
- 6-mercaptonicotinic acid
- 6-sulfanylidene-1h-pyridine-3-carboxylic acid
- 6-thioxo-1h-pyridine-3-carboxylic acid
- aj-333/25022012
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CAS Number(s) |
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InChIKey |
JWWGTYCXARQFOT-UHFFFAOYSA-N |
QR Code |
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Links |
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Downloads |
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Elements |
H
S
C
O
N
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