Formula |
C14H13Br2NO5S2 |
IUPAC Name |
2-[(5r)-5-[(2,3-dibromo-5-ethoxy-4-hydroxy-phenyl)methyl]-4-oxo-2-thioxo-thiazolidin-3-yl]acetic acid |
Molecular Mass |
499.195 g·mol−1 |
Heat of Formation |
-681.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.68 ± 1.08 D |
Volume |
435.25 Å 3 |
Surface Area |
365.68 Å 2 |
HOMO Energy |
-9.14 ± 0.55 eV |
LUMO Energy |
1.39 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
ABQHPGHMYXJJIV-MRVPVSSYSA-N |
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Elements |
C
H
O
N
S
Br
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