Formula |
C31H33Cl2NO9S |
IUPAC Name |
2-[3-[1-[1-(3,5-dichlorophenyl)sulfonylpiperidine-2-carbonyl]oxy-3-(3,4-dimethoxyphenyl)propyl]phenoxy]acetic acid |
Molecular Mass |
666.566 g·mol−1 |
Heat of Formation |
-1392.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.84 ± 1.08 D |
Volume |
725.49 Å 3 |
Surface Area |
555.69 Å 2 |
HOMO Energy |
-8.12 ± 0.55 eV |
LUMO Energy |
-1.17 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
AOMAGJKZRYWVSR-SVBPBHIXSA-N |
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Links |
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Elements |
C
Cl
H
O
N
S
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