Formula |
C11H22N2O3S |
IUPAC Name |
(2s)-2-[[(2s)-2-amino-4-methyl-pentanoyl]amino]-4-methylsulfanyl-butanoic acid |
Molecular Mass |
262.369 g·mol−1 |
Heat of Formation |
-684.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.74 ± 1.08 D |
Volume |
337.1 Å 3 |
Surface Area |
308.19 Å 2 |
HOMO Energy |
-8.54 ± 0.55 eV |
LUMO Energy |
3.12 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (2s)-2-[[(2s)-2-ammonio-4-methyl-1-oxopentyl]amino]-4-(methylthio)butanoate
- (2s)-2-[[(2s)-2-ammonio-4-methyl-pentanoyl]amino]-4-(methylthio)butyrate
- (2s)-2-[[(2s)-2-azaniumyl-4-methyl-pentanoyl]amino]-4-methylsulfanyl-butanoate
- (2s)-2-[[(2s)-2-azaniumyl-4-methylpentanoyl]amino]-4-methylsulfanylbutanoate
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InChIKey |
NTISAKGPIGTIJJ-IUCAKERBSA-N |
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Links |
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Elements |
H
S
C
O
N
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