Methyl 3-Cyclopentyl-1,6-Dimethyl-4-(3-Nitrophenyl)-2,4-Dihydro-1H-Pyrazolo[3,4-B]Pyridine-5-Carboxylate
Properties
Property | Value |
---|---|
Formula | C21H24N4O4 |
IUPAC Name | methyl 3-cyclopentyl-1,6-dimethyl-4-(3-nitrophenyl)-2,4-dihydro-1h-pyrazolo[3,4-b]pyridine-5-carboxylate |
Molecular Mass | 396.440 g·mol−1 |
Heat of Formation | 2606.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 9.93 ± 1.08 D |
Volume | 421.03 Å 3 |
Surface Area | 344.74 Å 2 |
HOMO Energy | -8.07 ± 0.55 eV |
LUMO Energy | -2.33 ± eV |
Point Group Symmetry | C1 |
InChIKey | UAXYSZUIYWEWRR-KRWDZBQOSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
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Elements | C O N |