Formula |
C24H27N5 |
IUPAC Name |
6-[2-[3-(aminomethyl)-5-(2-pyrrolo[2,3-b]pyridin-1-ium-7-id-6-ylethyl)phenyl]ethyl]-4-methyl-pyridin-2-amine |
Molecular Mass |
385.505 g·mol−1 |
Heat of Formation |
285.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.77 ± 1.08 D |
Volume |
489.67 Å 3 |
Surface Area |
445.72 Å 2 |
HOMO Energy |
-8.74 ± 0.55 eV |
LUMO Energy |
-0.32 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
WRRLIUHCTMZNNL-UHFFFAOYSA-N |
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Elements |
H
C
N
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