Formula |
C28H27N7O |
IUPAC Name |
[5-[4-(dimethylamino)-1-piperidyl]imidazo[4,5-b]pyridin-1-ium-3-id-2-yl]-[2-(4-isoquinolyl)-4-pyridyl]methanone |
Molecular Mass |
477.560 g·mol−1 |
Heat of Formation |
521.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
7.11 ± 1.08 D |
Volume |
564.23 Å 3 |
Surface Area |
491.2 Å 2 |
HOMO Energy |
-8.56 ± 0.55 eV |
LUMO Energy |
0.56 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
VSHURSPEQITHNX-UHFFFAOYSA-N |
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Elements |
H
C
O
N
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