3-(6-Ethoxy-2-Naphthyl)-1-Isopropyl-Pyrazolo[3,4-D]Pyrimidin-4-Amine

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Properties Simple | Detailed

Formula C20H21N5O
IUPAC Name 3-(6-ethoxy-2-naphthyl)-1-isopropyl-pyrazolo[3,4-d]pyrimidin-1-ium-4-ylium-4-amine
Molecular Mass 347.414 g·mol−1
Heat of Formation 224.2 ± 16.7 kJ·mol−1
Dipole Moment 4.75 ± 1.08 D
Volume 417.96 Å 3
Surface Area 374.66 Å 2
HOMO Energy -8.51 ± 0.55 eV
LUMO Energy -1.01 ± eV
Point Group Symmetry C1
InChIKey MJOCJDMQRCJQJF-UHFFFAOYSA-N
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