Formula |
C17H23BrN4O8S |
IUPAC Name |
(2s)-2-amino-5-[[(1r)-1-[[(r)-(4-bromo-n-hydroxy-anilino)-hydroxy-methyl]sulfanylmethyl]-2-(carboxymethylamino)-2-oxo-ethyl]amino]-5-oxo-pentanoic acid |
Molecular Mass |
523.356 g·mol−1 |
Heat of Formation |
-1254.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
0.72 ± 1.08 D |
Volume |
537.14 Å 3 |
Surface Area |
437.58 Å 2 |
HOMO Energy |
-9.31 ± 0.55 eV |
LUMO Energy |
-0.91 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
OGZMPQOWGQBWAV-NVGCLXPQSA-N |
QR Code |
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Links |
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Downloads |
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Elements |
C
H
O
N
S
Br
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