1-(1H-Indazol-5-Ylcarbonyl)-2'-(2-Methyl-2-Propanyl)-2'H-Spiro[Piperidine-4,5'-Pyrano[3,2-C]Pyrazol]-7'(6'H)-One
Properties
| Property | Value |
|---|---|
| Formula | C22H25N5O3 |
| IUPAC Name | 2-tert-butyl-1'-(1h-indazole-5-carbonyl)spiro[6h-pyrano[3,2-c]pyrazole-5,4'-piperidine]-7-one |
| Molecular Mass | 407.466 g·mol−1 |
| Heat of Formation | -80.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 8.47 ± 1.08 D |
| Volume | 479.54 Å 3 |
| Surface Area | 404.04 Å 2 |
| HOMO Energy | -9.04 ± 0.55 eV |
| LUMO Energy | 2.16 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | MDLAYXJCVDNKAB-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 |