(2R,4S,4As)-2,4-Dimethyl-8-Nitro-1,2,4,4A-Tetrahydro-2'H,6H-Spiro[1,4-Oxazino[4,3-A]Quinoline-5,5'-Pyrimidine]-2',4',6'(1'H,3'H)-Trione
Properties
Property | Value |
---|---|
Formula | C17H18N4O6 |
IUPAC Name | (2r,4r,4ar,11r)-2,4-dimethyl-8-nitro-spiro[2,4,4a,6-tetrahydro-1h-[1,4]oxazino[4,3-a]quinoline-5,5'-hexahydropyrimidine]-2',4',6'-trione |
Molecular Mass | 374.348 g·mol−1 |
Heat of Formation | -655.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.81 ± 1.08 D |
Volume | 402.04 Å 3 |
Surface Area | 324.52 Å 2 |
HOMO Energy | -8.85 ± 0.55 eV |
LUMO Energy | 2.05 ± eV |
Point Group Symmetry | C1 |
InChIKey | DJZPHYIXNUOVJU-KKFJDGPESA-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 |