(2R)-2-Amino-N-[[(2R,3R,4S,5S)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methylsulfamoyl]-4-Methylsulfanyl-Butanamide
Properties
Property | Value |
---|---|
Formula | C15H26N8O6S2 |
IUPAC Name | (2r)-2-amino-n-[[(2r,3r,4s,5s)-5-(6-aminopurine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methylsulfamoyl]-4-methylsulfanyl-butanamide |
Molecular Mass | 478.547 g·mol−1 |
Heat of Formation | -817.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.83 ± 1.08 D |
Volume | 518.95 Å 3 |
Surface Area | 439.67 Å 2 |
HOMO Energy | -8.61 ± 0.55 eV |
LUMO Energy | -0.68 ± eV |
Point Group Symmetry | C1 |
InChIKey | URZHNWOZJZDAPX-MLTWFIIGSA-O |
QR Code | Generate QR Code |
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Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C S O N |