Formula |
C25H21BrFN3O2 |
IUPAC Name |
2-[3-[(4-bromo-2-fluoro-phenyl)methyl]-4-oxo-phthalazin-1-yl]-n-(2,6-dimethylphenyl)acetamide |
Molecular Mass |
494.356 g·mol−1 |
Heat of Formation |
-207.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
1.85 ± 1.08 D |
Volume |
522.07 Å 3 |
Surface Area |
372.19 Å 2 |
HOMO Energy |
-8.98 ± 0.55 eV |
LUMO Energy |
1.96 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
YPWZRYOQYVTPGR-UHFFFAOYSA-N |
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Links |
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Elements |
C
F
H
O
N
Br
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