Formula |
C25H22Cl2N2O4 |
IUPAC Name |
2-[4-[[(1s)-1-[(2,4-dichlorophenyl)carbamoyl]isoindolin-2-yl]methyl]-2-methyl-phenoxy]acetic acid |
Molecular Mass |
485.359 g·mol−1 |
Heat of Formation |
-445.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.22 ± 1.08 D |
Volume |
543.13 Å 3 |
Surface Area |
472.0 Å 2 |
HOMO Energy |
-9.06 ± 0.55 eV |
LUMO Energy |
2.38 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
MRCUMHGGUAFXSG-DEOSSOPVSA-N |
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Elements |
H
C
N
O
Cl
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