Formula |
C29H25Cl2N3O4 |
IUPAC Name |
6-[4-[[3-(3,5-dichloro-4-pyridyl)-5-isopropyl-isoxazol-4-yl]methoxy]-2-methyl-phenyl]-1-methyl-indole-3-carboxylic acid |
Molecular Mass |
550.432 g·mol−1 |
Heat of Formation |
-240.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
7.87 ± 1.08 D |
Volume |
625.03 Å 3 |
Surface Area |
519.12 Å 2 |
HOMO Energy |
-8.80 ± 0.55 eV |
LUMO Energy |
1.85 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
JTRRVYQZHXAOGI-UHFFFAOYSA-N |
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Elements |
H
C
Cl
O
N
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