Formula |
C14H14N2O5S2 |
IUPAC Name |
(2r)-2-[(r)-carboxy-[[2-(2-thienyl)acetyl]amino]methyl]-5-methylene-2h-1,3-thiazine-4-carboxylic acid |
Molecular Mass |
354.401 g·mol−1 |
Heat of Formation |
-606.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.16 ± 1.08 D |
Volume |
389.48 Å 3 |
Surface Area |
342.52 Å 2 |
HOMO Energy |
-8.94 ± 0.55 eV |
LUMO Energy |
-1.14 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (2r)-2-[(1r)-2-hydroxy-2-keto-1-[[2-(2-thienyl)acetyl]amino]ethyl]-5-methylene-2h-1,3-thiazine-4-carboxylic acid
- (2r)-2-[(1r)-2-hydroxy-2-oxo-1-(2-thiophen-2-ylethanoylamino)ethyl]-5-methylidene-2h-1,3-thiazine-4-carboxylic acid
- (2r)-2-[(1r)-2-hydroxy-2-oxo-1-[[1-oxo-2-(2-thienyl)ethyl]amino]ethyl]-5-methylene-2h-1,3-thiazine-4-carboxylic acid
- (2r)-2-[(1r)-2-hydroxy-2-oxo-1-[[2-(2-thienyl)acetyl]amino]ethyl]-5-methylene-2h-1,3-thiazine-4-carboxylic acid
- cep
|
InChIKey |
PYSTWTYTGVRHPO-NWDGAFQWSA-N |
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Links |
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Elements |
H
S
C
O
N
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