(2R,4Ar,6R,7R,7Ar)-6-(7H-Diimidazo[3,4-D:1',3'-F]Triazine-1,6,9-Triium-7-Id-3-Yl)-2-Hydroxy-2-Oxo-4A,6,7,7A-Tetrahydro-4H-Furo[3,2-D][1,3,2]Dioxaphosphinin-7-Ol

Molecule SVG Image

Properties Simple | Detailed

Formula C11H15N6O6P
IUPAC Name (2r,4ar,6r,7r,7ar)-6-(7h-diimidazo[3,4-d:1',3'-f]triazine-1,6,9-triium-7-id-3-yl)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol
Molecular Mass 358.247 g·mol−1
Heat of Formation -761.3 ± 16.7 kJ·mol−1
Dipole Moment 6.90 ± 1.08 D
Volume 346.27 Å 3
Surface Area 300.8 Å 2
HOMO Energy -9.35 ± 0.55 eV
LUMO Energy -1.38 ± eV
Point Group Symmetry C1
InChIKey FLQJIVUYOCPFKE-XPEZWYTCSA-O
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements P C H O N