Formula |
C16H20N2O5S |
IUPAC Name |
(2r,4r)-2-[(s)-carboxy-[(2-phenylacetyl)amino]methyl]-5,5-dimethyl-thiazolidine-4-carboxylic acid |
Molecular Mass |
352.405 g·mol−1 |
Heat of Formation |
-861.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.94 ± 1.08 D |
Volume |
403.2 Å 3 |
Surface Area |
307.68 Å 2 |
HOMO Energy |
-8.92 ± 0.55 eV |
LUMO Energy |
-0.45 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
HCYWNSXLUZRKJX-JHJVBQTASA-N |
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Elements |
H
S
C
O
N
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