Formula |
C25H24N4O2 |
IUPAC Name |
n-[2,4-dimethyl-5-(3-methyl-4h-imidazol-3-ium-4-ylium-5-yl)phenyl]-4-(2-pyridylmethoxy)benzamide |
Molecular Mass |
412.484 g·mol−1 |
Heat of Formation |
81.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.90 ± 1.08 D |
Volume |
497.87 Å 3 |
Surface Area |
449.05 Å 2 |
HOMO Energy |
-8.22 ± 0.55 eV |
LUMO Energy |
-0.70 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
SMQVBAGSZVHCJP-UHFFFAOYSA-N |
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Elements |
H
C
O
N
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