(5Ar,7R,8R,8As)-8-Hydroxy-7-(Hydroxymethyl)-3-Methyl-5A,7,8,8A-Tetrahydro-2H-Furo[2',3':4,5][1,3]Oxazolo[3,2-A][1,3,5]Triazine-2,4(3H)-Dione
Properties
Property | Value |
---|---|
Formula | C9H11N3O6 |
IUPAC Name | 5-hydroxy-4-(hydroxymethyl)-11-methyl-3,7-dioxa-1,9,11-triazatricyclo[6.4.0.02,6]dodec-8-ene-10,12-dione |
Molecular Mass | 257.200 g·mol−1 |
Heat of Formation | -930.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.44 ± 1.08 D |
Volume | 264.09 Å 3 |
Surface Area | 234.86 Å 2 |
HOMO Energy | -10.63 ± 0.55 eV |
LUMO Energy | 2.30 ± eV |
Point Group Symmetry | C1 |
InChIKey | DWLTVXYJYDFYTQ-ARQDHWQXSA-P |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |