3-(4-Amino-1-Tert-Butyl-Pyrazolo[3,4-D]Pyrimidine-5,7-Diium-3A-Id-3-Yl)Phenol
Properties
Property | Value |
---|---|
Formula | C15H17N5O |
IUPAC Name | 3-(4-amino-1-tert-butyl-pyrazolo[3,4-d]pyrimidine-5,7-diium-3a-id-3-yl)phenol |
Molecular Mass | 283.328 g·mol−1 |
Heat of Formation | 135.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.11 ± 1.08 D |
Volume | 338.8 Å 3 |
Surface Area | 300.09 Å 2 |
HOMO Energy | -8.79 ± 0.55 eV |
LUMO Energy | 2.51 ± eV |
Point Group Symmetry | C1 |
InChIKey | YCPHKQJMFNEELJ-UHFFFAOYSA-O |
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Elements | H C O N |