[(2R,3S,4R,5R)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl 3-(4-Hydroxyphenyl)Propyl Hydrogen Phosphate
Properties
Property | Value |
---|---|
Formula | C19H26N5O8P |
IUPAC Name | [(2r,3s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl 3-(4-hydroxyphenyl)propyl hydrogen phosphate |
Molecular Mass | 483.412 g·mol−1 |
Heat of Formation | -1412.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 1.93 ± 1.08 D |
Volume | 526.03 Å 3 |
Surface Area | 430.96 Å 2 |
HOMO Energy | -8.99 ± 0.55 eV |
LUMO Energy | -0.57 ± eV |
Point Group Symmetry | C1 |
InChIKey | FBJCLRQPOAMFNL-NVQRDWNXSA-O |
QR Code | Generate QR Code |
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Elements | P C H O N |