(2S,3S,4R,5R)-5-[6-Amino-2-(2-Phenylethylamino)Purine-1,3,7-Triium-9-Yl]-N-Ethyl-3,4-Dihydroxy-Tetrahydrofuran-2-Carboxamide
Properties
Property | Value |
---|---|
Formula | C20H25N7O4 |
IUPAC Name | (2s,3s,4r,5r)-5-[6-amino-2-(2-phenylethylamino)purine-1,3,7-triium-9-yl]-n-ethyl-3,4-dihydroxy-tetrahydrofuran-2-carboxamide |
Molecular Mass | 427.457 g·mol−1 |
Heat of Formation | -406.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 1.46 ± 1.08 D |
Volume | 490.51 Å 3 |
Surface Area | 432.67 Å 2 |
HOMO Energy | -8.37 ± 0.55 eV |
LUMO Energy | 3.06 ± eV |
Point Group Symmetry | C1 |
InChIKey | YIYNRNHBNFFILF-QCUYGVNKSA-O |
QR Code | Generate QR Code |
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Elements | H C O N |