N-[2-(6-Amino-9H-Purin-9-Yl)Ethyl]-5-Hydroxy-1-Pentanaminium

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Properties Simple | Detailed

Formula C12H20N6O
IUPAC Name 5-[2-(6-aminopurine-1,3,7-triium-9-yl)ethylamino]pentan-1-ol
Molecular Mass 264.327 g·mol−1
Heat of Formation 20.8 ± 16.7 kJ·mol−1
Dipole Moment 0.82 ± 1.08 D
Volume 331.33 Å 3
Surface Area 315.48 Å 2
HOMO Energy -8.93 ± 0.55 eV
LUMO Energy 2.60 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(6-amino-9-purinyl)ethyl-(5-hydroxypentyl)ammonium
  • 2-(6-aminopurin-9-yl)ethyl-(5-hydroxypentyl)ammonium
InChIKey CVPTTZZCRDVGSU-UHFFFAOYSA-O
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