Sonedenoson

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Properties Simple | Detailed

Formula C18H20ClN5O5
IUPAC Name (2r,3r,4s,5r)-2-[6-amino-2-[2-(4-chlorophenyl)ethoxy]purin-9-ium-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
Molecular Mass 421.835 g·mol−1
Heat of Formation -591.7 ± 16.7 kJ·mol−1
Dipole Moment 4.96 ± 1.08 D
Volume 465.3 Å 3
Surface Area 369.71 Å 2
HOMO Energy -8.94 ± 0.55 eV
LUMO Energy -0.38 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r,4s,5r)-2-[6-amino-2-[2-(4-chlorophenyl)ethoxy]-9-purinyl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
  • (2r,3r,4s,5r)-2-[6-amino-2-[2-(4-chlorophenyl)ethoxy]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
  • (2r,3r,4s,5r)-2-[6-amino-2-[2-(4-chlorophenyl)ethoxy]purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
  • (2r,3r,4s,5r)-2-[6-amino-2-[2-(4-chlorophenyl)ethoxy]purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol
InChIKey WUCQGGOGHZRELS-LSCFUAHRSA-N
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Elements H C N O Cl