2-(1H-Purin-6-Yl)-2,9-Diazaspiro[5.5]Undecane

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Properties Simple | Detailed

Formula C14H20N6
IUPAC Name 2-(9h-purine-1,3,7-triium-6-yl)-2,9-diazaspiro[5.5]undecane
Molecular Mass 272.349 g·mol−1
Heat of Formation 221.4 ± 16.7 kJ·mol−1
Dipole Moment 2.49 ± 1.08 D
Volume 327.01 Å 3
Surface Area 276.72 Å 2
HOMO Energy -8.56 ± 0.55 eV
LUMO Energy -0.68 ± eV
Point Group Symmetry C1
InChIKey NQWBGODZSPAAMM-UHFFFAOYSA-O
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Elements H C N