Formula |
C28H23ClF2N4O4 |
IUPAC Name |
n-[4-(2-chloro-5-methyl-pyrimidin-4-yl)phenyl]-n-[[4-[[(2,2-difluoroacetyl)amino]methyl]phenyl]methyl]-2,4-dihydroxy-benzamide |
Molecular Mass |
552.956 g·mol−1 |
Heat of Formation |
-719.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
9.02 ± 1.08 D |
Volume |
613.93 Å 3 |
Surface Area |
503.77 Å 2 |
HOMO Energy |
-9.13 ± 0.55 eV |
LUMO Energy |
2.10 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
LCGNLQSOSJFLKR-UHFFFAOYSA-N |
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Elements |
C
Cl
H
F
O
N
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