7-[2-[Bis(2-Hydroxyethyl)Amino]Ethyl]-1,3-Dimethyl-Purin-9-Ium-5-Ide-2,6-Dione

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Properties Simple | Detailed

Formula C13H22N5O4
IUPAC Name 7-[2-[bis(2-hydroxyethyl)amino]ethyl]-1,3-dimethyl-purin-9-ium-5-ide-2,6-dione
Molecular Mass 312.345 g·mol−1
Heat of Formation -582.1 ± 16.7 kJ·mol−1
Dipole Moment 3.60 ± 1.08 D
Volume 368.78 Å 3
Surface Area 322.81 Å 2
HOMO Energy -9.17 ± 0.55 eV
LUMO Energy -0.71 ± eV
Point Group Symmetry C1
InChIKey OWULMNRBTVHDGC-UHFFFAOYSA-P
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