Formula |
C21H23N3O8S |
IUPAC Name |
(2s)-5-[[(1r)-2-(carboxymethylamino)-2-oxo-1-(sulfanylmethyl)ethyl]amino]-2-[(3-methyl-1,4-dioxo-2-naphthyl)amino]-5-oxo-pentanoic acid |
Molecular Mass |
477.488 g·mol−1 |
Heat of Formation |
-1268.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.34 ± 1.08 D |
Volume |
553.62 Å 3 |
Surface Area |
418.69 Å 2 |
HOMO Energy |
-9.19 ± 0.55 eV |
LUMO Energy |
-1.80 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
QBKWQVMOOFZDRW-KBPBESRZSA-N |
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Links |
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Elements |
H
S
C
O
N
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