(4R,4A'S,10A'S)-7'-(5-Chloro-3-Pyridinyl)-3',4',4A',10A'-Tetrahydro-1'H-Spiro[1,3-Oxazole-4,5'-Pyrano[3,4-B]Chromen]-2-Amine
Properties
| Property | Value |
|---|---|
| Formula | C19H18ClN3O3 |
| IUPAC Name | (4as,5r,10as)-7-(5-chloro-3-pyridyl)spiro[3,4,4a,10a-tetrahydro-1h-pyrano[3,4-b]chromene-5,4'-5h-oxazole]-2'-amine |
| Molecular Mass | 371.818 g·mol−1 |
| Heat of Formation | -217.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.96 ± 1.08 D |
| Volume | 407.74 Å 3 |
| Surface Area | 353.78 Å 2 |
| HOMO Energy | -9.01 ± 0.55 eV |
| LUMO Energy | 2.30 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | BGRWOLNAPSRJIS-LSBZLQRGSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C Cl O N |