6-(4-Benzoylphenyl)-1-(4-Pyridinylmethyl)-1H-Pyrazolo[3,4-B]Pyridine-4-Carboxylic Acid
Properties
Property | Value |
---|---|
Formula | C26H18N4O3 |
IUPAC Name | 6-(4-benzoylphenyl)-1-(4-pyridylmethyl)pyrazolo[3,4-b]pyridin-1-ium-4-carboxylic acid |
Molecular Mass | 434.446 g·mol−1 |
Heat of Formation | 163.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.07 ± 1.08 D |
Volume | 501.21 Å 3 |
Surface Area | 432.72 Å 2 |
HOMO Energy | -9.62 ± 0.55 eV |
LUMO Energy | 1.44 ± eV |
Point Group Symmetry | C1 |
InChIKey | PTCVSDDJAQNAKH-UHFFFAOYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |