Formula |
C40H42N6O2 |
IUPAC Name |
[(2s)-2-(2-phenylbenzimidazol-1-ium-1-yl)-2-(4-piperidyl)ethyl] 1-(1-benzylbenzimidazol-2-yl)piperidine-4-carboxylate |
Molecular Mass |
638.800 g·mol−1 |
Heat of Formation |
218.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.47 ± 1.08 D |
Volume |
780.05 Å 3 |
Surface Area |
559.24 Å 2 |
HOMO Energy |
-8.73 ± 0.55 eV |
LUMO Energy |
2.76 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
WDALFJYWTFDSRP-DIPNUNPCSA-N |
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Links |
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Elements |
H
C
O
N
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