Formula |
C6H9N3O2S |
IUPAC Name |
(2s)-2-azaniumyl-3-(2-thioxo-1,3-dihydroimidazol-4-yl)propanoate |
Molecular Mass |
187.220 g·mol−1 |
Heat of Formation |
-253.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.95 ± 1.08 D |
Volume |
213.37 Å 3 |
Surface Area |
202.9 Å 2 |
HOMO Energy |
-8.17 ± 0.55 eV |
LUMO Energy |
2.87 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (2s)-2-amino-3-(2-sulfanylidene-1,3-dihydroimidazol-4-yl)propanoic acid
- (2s)-2-amino-3-(2-thioxo-1,3-dihydroimidazol-4-yl)propanoic acid
- (2s)-2-amino-3-(2-thioxo-1,3-dihydroimidazol-4-yl)propionic acid
- (s)-alpha-amino-2,3-dihydro-2-thioxo-1h-imidazole-4-propionic acid
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CAS Number(s) |
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InChIKey |
FVNKWWBXNSNIAR-BYPYZUCNSA-N |
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Links |
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Downloads |
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Elements |
H
S
C
O
N
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