(2S,3S,4R,5R)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-N-Cyclopropyl-3,4-Dihydroxy-Tetrahydrofuran-2-Carboxamide
Properties
Property | Value |
---|---|
Formula | C13H16N6O4 |
IUPAC Name | (2s,3s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-n-cyclopropyl-3,4-dihydroxy-tetrahydrofuran-2-carboxamide |
Molecular Mass | 320.304 g·mol−1 |
Heat of Formation | -352.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.25 ± 1.08 D |
Volume | 350.91 Å 3 |
Surface Area | 313.78 Å 2 |
HOMO Energy | -8.96 ± 0.55 eV |
LUMO Energy | -0.41 ± eV |
Point Group Symmetry | C1 |
InChIKey | SJTGIMSQBYKIQP-QRIDJOKKSA-O |
QR Code | Generate QR Code |
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Elements | H C O N |