| Formula |
C12H17Cl2N3O6S |
| IUPAC Name |
(2s)-2-amino-5-[[(1r)-2-(carboxymethylamino)-1-[[(z)-1,2-dichlorovinyl]sulfanylmethyl]-2-oxo-ethyl]amino]-5-oxo-pentanoic acid |
| Molecular Mass |
402.251 g·mol−1 |
| Heat of Formation |
-1100.9 ± 16.7 kJ·mol−1 |
| Dipole Moment |
3.68 ± 1.08 D |
| Volume |
432.27 Å 3 |
| Surface Area |
379.65 Å 2 |
| HOMO Energy |
-9.34 ± 0.55 eV |
| LUMO Energy |
-1.05 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- (2s)-2-amino-5-[[(1r)-2-(carboxymethylamino)-1-[[(z)-1,2-dichlorovinyl]sulfanylmethyl]-2-oxo-ethyl]amino]-5-oxo-pentanoic acid
- (2s)-2-amino-5-[[(1r)-2-(carboxymethylamino)-1-[[[(z)-1,2-dichlorovinyl]thio]methyl]-2-keto-ethyl]amino]-5-keto-valeric acid
- (2s)-2-amino-5-[[(1r)-2-(carboxymethylamino)-1-[[[(z)-1,2-dichlorovinyl]thio]methyl]-2-oxoethyl]amino]-5-oxopentanoic acid
- (2s)-2-amino-5-[[(2r)-1-(carboxymethylamino)-3-[(z)-1,2-dichloroethenyl]sulfanyl-1-oxo-propan-2-yl]amino]-5-oxo-pentanoic acid
|
| InChIKey |
IXARYIJEQUJTIZ-AXUBEFTGSA-N |
| QR Code |
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| Links |
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| DOI |
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| Downloads |
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|
| Elements |
C
Cl
H
O
N
S
|
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