N-(3,4-Dimethoxyphenyl)-2-(1H-Pyrazol-4-Yl)-1H-Pyrrolo[3,2-C]Pyridin-6-Amine

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Properties Simple | Detailed

Formula C18H17N5O2
IUPAC Name n-(3,4-dimethoxyphenyl)-2-(3h-pyrazol-2-ium-3-ylium-4-yl)-7h-pyrrolo[3,2-c]pyridin-1-ium-7-id-6-amine
Molecular Mass 335.360 g·mol−1
Heat of Formation 211.5 ± 16.7 kJ·mol−1
Dipole Moment 2.66 ± 1.08 D
Volume 382.2 Å 3
Surface Area 357.94 Å 2
HOMO Energy -7.68 ± 0.55 eV
LUMO Energy -0.82 ± eV
Point Group Symmetry C1
InChIKey UIEXDKQSWATHMD-UHFFFAOYSA-N
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