6-(1H-Pyrazolo[3,4-B]Pyridin-5-Yl)-4-(4-Pyridinyl)Quinoline

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Properties Simple | Detailed

Formula C20H13N5
IUPAC Name 6-pyrazolo[3,4-b]pyridin-1-ium-2-id-5-yl-4-(4-pyridyl)quinoline
Molecular Mass 323.351 g·mol−1
Heat of Formation 650.5 ± 16.7 kJ·mol−1
Dipole Moment 1.80 ± 1.08 D
Volume 374.83 Å 3
Surface Area 333.06 Å 2
HOMO Energy -9.31 ± 0.55 eV
LUMO Energy -1.18 ± eV
Point Group Symmetry C1
InChIKey PYHJWHYHRSDRDJ-UHFFFAOYSA-N
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Elements H C N