Formula |
C20H21N3O3 |
IUPAC Name |
(2s)-2-[[(2s)-2-amino-3-phenyl-propanoyl]amino]-3-(1h-indol-3-yl)propanoic acid |
Molecular Mass |
351.399 g·mol−1 |
Heat of Formation |
-316.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.79 ± 1.08 D |
Volume |
437.2 Å 3 |
Surface Area |
342.85 Å 2 |
HOMO Energy |
-8.71 ± 0.55 eV |
LUMO Energy |
-0.31 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (2s)-2-[[(2s)-2-ammonio-1-oxo-3-phenylpropyl]amino]-3-(1h-indol-3-yl)propanoate
- (2s)-2-[[(2s)-2-ammonio-3-phenyl-propanoyl]amino]-3-(1h-indol-3-yl)propionate
- (2s)-2-[[(2s)-2-azaniumyl-3-phenyl-propanoyl]amino]-3-(1h-indol-3-yl)propanoate
- (2s)-2-[[(2s)-2-azaniumyl-3-phenylpropanoyl]amino]-3-(1h-indol-3-yl)propanoate
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CAS Number(s) |
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InChIKey |
JMCOUWKXLXDERB-WMZOPIPTSA-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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