(2S)-2-Amino-N-[[(2R,3S,4R,5R)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methylsulfamoyl]-3-Methyl-Butanamide
Properties
Property | Value |
---|---|
Formula | C15H24N8O6S |
IUPAC Name | (2s)-2-amino-n-[[(2r,3s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methylsulfamoyl]-3-methyl-butanamide |
Molecular Mass | 444.466 g·mol−1 |
Heat of Formation | -898.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.71 ± 1.08 D |
Volume | 483.12 Å 3 |
Surface Area | 381.15 Å 2 |
HOMO Energy | -9.19 ± 0.55 eV |
LUMO Energy | -0.64 ± eV |
Point Group Symmetry | C1 |
InChIKey | NZEOCBFVVALOLJ-CYUGOOACSA-O |
QR Code | Generate QR Code |
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Elements | H C S O N |