2-Amino-9-[(1R,2R,3R)-2,3-Bis(Hydroxymethyl)Cyclobutyl]-3,9-Dihydro-6H-Purin-6-One

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Formula C11H22N5O3+
IUPAC Name 2-amino-9-[(1r,2r,3r)-2,3-bis(hydroxymethyl)cyclobutyl]-3,8-dihydropurine-1,2,4,5,7,8-hexaid-6-one
Molecular Mass 272.324 g·mol−1
Heat of Formation -236.8 ± 16.7 kJ·mol−1
Dipole Moment 10.87 ± 1.08 D
Volume 303.34 Å 3
Surface Area 272.59 Å 2
HOMO Energy -9.12 ± 0.55 eV
LUMO Energy -0.11 ± eV
Point Group Symmetry C1
Synonyms
  • 2-amino-9-[(1r,2r,3r)-2,3-bis(hydroxymethyl)cyclobutyl]-3h-purin-6-one
  • 2-amino-9-[(1r,2r,3r)-2,3-dimethylolcyclobutyl]-3h-purin-6-one
InChIKey GWFOVSGRNGAGDL-RRKCRQDMSA-N
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