| Formula |
C26H33BrN2O6S |
| IUPAC Name |
(3s,4s)-5-benzylsulfanyl-3-[[(2s)-2-[[2-(5-bromo-2-methoxy-phenyl)acetyl]amino]-3-methyl-butanoyl]amino]-4-hydroxy-pentanoic acid |
| Molecular Mass |
581.519 g·mol−1 |
| Heat of Formation |
-1050.6 ± 16.7 kJ·mol−1 |
| Dipole Moment |
5.70 ± 1.08 D |
| Volume |
646.38 Å 3 |
| Surface Area |
513.67 Å 2 |
| HOMO Energy |
-8.75 ± 0.55 eV |
| LUMO Energy |
2.46 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
IQHLJYZLDAEITK-BKSPAHHJSA-N |
| QR Code |
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| Links |
ChemSpider
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| DOI |
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| Downloads |
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|
| Elements |
C
H
O
N
S
Br
|
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