(1R,2S)-2-{[8-Oxo-2-(1H-Pyrazol-4-Yl)-5,8-Dihydropyrido[3,4-D]Pyrimidin-4-Yl]Amino}Cyclopentanecarbonitrile
Properties
Property | Value |
---|---|
Formula | C16H15N7O |
IUPAC Name | (1r,2s)-2-[[8-oxo-2-(1h-pyrazol-4-yl)-5h-pyrido[3,4-d]pyrimidin-4-yl]amino]cyclopentanecarbonitrile |
Molecular Mass | 321.337 g·mol−1 |
Heat of Formation | 405.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.29 ± 1.08 D |
Volume | 371.46 Å 3 |
Surface Area | 329.39 Å 2 |
HOMO Energy | -9.29 ± 0.55 eV |
LUMO Energy | 1.91 ± eV |
Point Group Symmetry | C1 |
InChIKey | GGNYHYINELGWQU-CABZTGNLSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
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Elements | H C O N |