Formula |
C28H26ClF2N3O |
IUPAC Name |
(2s)-2-[2-(4-chlorophenyl)-5,6-difluoro-benzimidazol-1-yl]-2-cyclohexyl-n-(o-tolyl)acetamide |
Molecular Mass |
493.975 g·mol−1 |
Heat of Formation |
-294.8 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.55 ± 1.08 D |
Volume |
568.93 Å 3 |
Surface Area |
435.58 Å 2 |
HOMO Energy |
-9.04 ± 0.55 eV |
LUMO Energy |
-1.11 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
LUMVOGPLODDMEP-SANMLTNESA-N |
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Elements |
C
Cl
H
F
O
N
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