2-Amino-9-[(2S,3S,3Ar,7Ar,9R,10R,10As,14As)-9-(6-Amino-9H-Purin-9-Yl)-3,5,10,12-Tetrahydroxy-5,12-Dioxidooctahydro-2H,7H-Difuro[3,2-D:3',2'-J][1,3,7,9,2,8]Tetraoxadiphosphacyclododecin-2-Yl]-3,9-Dihydro-6H-Purin-6-One
Properties
Property | Value |
---|---|
Formula | C20H24N10O13P2 |
IUPAC Name | 2-amino-9-[(2s,3s,3ar,7ar,9r,10r,10as,14as)-9-(6-amino-9h-purin-9-yl)-3,5,10,12-tetrahydroxy-5,12-dioxidooctahydro-2h,7h-difuro[3,2-d:3',2'-j][1,3,7,9,2,8]tetraoxadiphosphacyclododecin-2-yl]-3,9-dihydro-6h-purin-6-one |
Molecular Mass | 674.411 g·mol−1 |
Heat of Formation | -2289.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 14.78 ± 1.08 D |
Volume | 666.7 Å 3 |
Surface Area | 507.78 Å 2 |
HOMO Energy | -9.03 ± 0.55 eV |
LUMO Energy | -1.00 ± eV |
Point Group Symmetry | C1 |
InChIKey | RFCBNSCSPXMEBK-QXISTCNFSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | P C H O N |