Formula |
C9H14N4O3 |
IUPAC Name |
(2r)-2-[[(2s)-2-aminopropanoyl]amino]-3-imidazol-3-ium-4-ylium-4-yl-propanoic acid |
Molecular Mass |
226.232 g·mol−1 |
Heat of Formation |
-455.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.68 ± 1.08 D |
Volume |
269.52 Å 3 |
Surface Area |
238.35 Å 2 |
HOMO Energy |
-9.56 ± 0.55 eV |
LUMO Energy |
0.17 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (2r)-2-(alanylamino)-3-(3h-imidazol-4-yl)propionic acid
- (2r)-2-[[(2s)-2-amino-1-oxopropyl]amino]-3-(3h-imidazol-4-yl)propanoic acid
- (2r)-2-[[(2s)-2-aminopropanoyl]amino]-3-(3h-imidazol-4-yl)propanoic acid
- ala-his
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InChIKey |
XZWXFWBHYRFLEF-CAHLUQPWSA-N |
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Links |
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DOI |
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Downloads |
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Elements |
H
C
O
N
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