Formula |
C6H8N2O4 |
IUPAC Name |
(2s)-2-amino-3-(3-oxoisoxazol-5-yl)propanoic acid |
Molecular Mass |
172.139 g·mol−1 |
Heat of Formation |
-492.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.00 ± 1.08 D |
Volume |
191.53 Å 3 |
Surface Area |
187.82 Å 2 |
HOMO Energy |
-9.92 ± 0.55 eV |
LUMO Energy |
2.48 ± eV |
Point Group Symmetry |
C1
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Synonyms
|
- (2s)-2-amino-3-(3-ketoisoxazol-5-yl)propionic acid
- (2s)-2-amino-3-(3-oxo-1,2-oxazol-5-yl)propanoic acid
- (2s)-2-amino-3-(3-oxo-5-isoxazolyl)propanoic acid
- (2s)-2-amino-3-(3-oxoisoxazol-5-yl)propanoic acid
- pdsp1_001437
- pdsp2_001421
|
InChIKey |
PEHXWVXZPICGAV-BYPYZUCNSA-N |
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Links |
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Downloads |
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Elements |
H
C
O
N
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