Formula |
C26H21N7O4 |
IUPAC Name |
n4-[4-(4,5-dihydro-1h-imidazol-2-yl)phenyl]-n1-[4-(4h-imidazol-3-ium-4-ylium-2-yl)phenyl]-2-nitro-terephthalamide |
Molecular Mass |
495.489 g·mol−1 |
Heat of Formation |
226.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.98 ± 1.08 D |
Volume |
552.17 Å 3 |
Surface Area |
498.37 Å 2 |
HOMO Energy |
-8.77 ± 0.55 eV |
LUMO Energy |
1.05 ± eV |
Point Group Symmetry |
C1
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InChIKey |
OPTOKWNMZJTIEO-UHFFFAOYSA-N |
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Elements |
H
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