N~3~-(4-Fluorophenyl)-3H-Pyrazolo[3,4-D]Pyrimidine-3,4-Diamine

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Properties Simple | Detailed

Formula C11H9FN6
IUPAC Name (3s)-n3-(4-fluorophenyl)-3h-pyrazolo[3,4-d]pyrimidine-3,4-diamine
Molecular Mass 244.228 g·mol−1
Heat of Formation 337.8 ± 16.7 kJ·mol−1
Dipole Moment 5.49 ± 1.08 D
Volume 269.01 Å 3
Surface Area 251.54 Å 2
HOMO Energy -9.07 ± 0.55 eV
LUMO Energy -1.65 ± eV
Point Group Symmetry C1
InChIKey SIIPGZWXUQVYMG-NSHDSACASA-N
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Elements H C N F