Formula |
C19H26N4O10S |
IUPAC Name |
(2s)-2-amino-5-[[(1r)-2-(carboxymethylamino)-1-[[(1s)-1-(hydroxymethyl)-2-(4-nitrophenoxy)ethyl]sulfanylmethyl]-2-oxo-ethyl]amino]-5-oxo-pentanoic acid |
Molecular Mass |
502.496 g·mol−1 |
Heat of Formation |
-1416.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.73 ± 1.08 D |
Volume |
565.88 Å 3 |
Surface Area |
498.81 Å 2 |
HOMO Energy |
-9.12 ± 0.55 eV |
LUMO Energy |
-1.24 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
YWXHXYSGHBAIBL-KKUMJFAQSA-N |
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Links |
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Elements |
H
S
C
O
N
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