1-Cyclobutyl-3-(3,4-Dimethoxyphenyl)Pyrazolo[3,4-D]Pyrimidin-4-Amine

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Formula C17H19N5O2
IUPAC Name 1-cyclobutyl-3-(3,4-dimethoxyphenyl)pyrazolo[3,4-d]pyrimidin-1-ium-2-id-4-amine
Molecular Mass 325.365 g·mol−1
Heat of Formation 124.0 ± 16.7 kJ·mol−1
Dipole Moment 3.21 ± 1.08 D
Volume 382.75 Å 3
Surface Area 343.96 Å 2
HOMO Energy -8.49 ± 0.55 eV
LUMO Energy -0.70 ± eV
Point Group Symmetry C1
InChIKey ITOYZJGFTNTKKR-UHFFFAOYSA-N
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