8-(2-Hydroxypropyl)-9-Pentofuranosyl-9H-Purin-6-Amine

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Properties Simple | Detailed

Formula C13H19N5O5
IUPAC Name (2r,3r,4r,5s)-2-[6-amino-8-[(2s)-2-hydroxypropyl]purin-9-ium-8-ylium-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
Molecular Mass 325.320 g·mol−1
Heat of Formation -759.9 ± 16.7 kJ·mol−1
Dipole Moment 2.42 ± 1.08 D
Volume 361.28 Å 3
Surface Area 319.9 Å 2
HOMO Energy -9.22 ± 0.55 eV
LUMO Energy -0.77 ± eV
Point Group Symmetry C1
InChIKey WMCYWCMJHJUXSU-OQIRQZMPSA-N
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