(2R,3R,4S,5R)-2-[6-[(4-Azidophenyl)Methylamino]Purine-1,3,7-Triium-9-Yl]-5-(Hydroxymethyl)Tetrahydrofuran-3,4-Diol
Properties
Property | Value |
---|---|
Formula | C17H20N8O4 |
IUPAC Name | (2r,3s,4r,5r)-2-(hydroxymethyl)-5-[6-[[4-[(imino-λ5-azanylidene)amino]phenyl]methylamino]purin-9-yl]tetrahydrofuran-3,4-diol |
Molecular Mass | 400.392 g·mol−1 |
Heat of Formation | -44.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.98 ± 1.08 D |
Volume | 441.57 Å 3 |
Surface Area | 391.84 Å 2 |
HOMO Energy | -9.04 ± 0.55 eV |
LUMO Energy | 2.05 ± eV |
Point Group Symmetry | C1 |
InChIKey | LMFWMFWXYOLNEW-LSCFUAHRSA-O |
QR Code | Generate QR Code |
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Elements | H C O N |