Formula |
C27H19Cl2FN4O3 |
IUPAC Name |
2-[3-(2-chloro-n-[1-(2-chlorophenyl)-6-oxo-pyridazin-3-yl]-4-fluoro-anilino)propyl]isoindoline-1,3-dione |
Molecular Mass |
537.369 g·mol−1 |
Heat of Formation |
-235.8 ± 16.7 kJ·mol−1 |
Dipole Moment |
1.59 ± 1.08 D |
Volume |
568.91 Å 3 |
Surface Area |
416.42 Å 2 |
HOMO Energy |
-8.62 ± 0.55 eV |
LUMO Energy |
1.77 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
QGJNGXXVCVFADC-UHFFFAOYSA-O |
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Links |
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Elements |
C
Cl
H
F
O
N
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