Formula |
C16H23N5O8S |
IUPAC Name |
(2s)-2-amino-5-[[(2r)-2-amino-3-[(1r)-2-carboxy-1-(1h-imidazol-5-yl)ethyl]sulfanyl-propanoyl]-(carboxymethyl)amino]-5-oxo-pentanoic acid |
Molecular Mass |
445.448 g·mol−1 |
Heat of Formation |
-1431.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.70 ± 1.08 D |
Volume |
500.89 Å 3 |
Surface Area |
377.22 Å 2 |
HOMO Energy |
-9.17 ± 0.55 eV |
LUMO Energy |
-0.47 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
LISSZDOYKZVZMS-ATZCPNFKSA-N |
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Elements |
H
S
C
O
N
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