(2R,5S)-5-Amino-2-[[(2S,3R,4R,5R)-5-(6-Aminopurin-9-Ium-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl]-2-Ethyl-Blahcyclohexan-6-One
Properties
Property | Value |
---|---|
Formula | C16H24N6O5S |
IUPAC Name | (2r,5s)-5-amino-2-[[(2s,3r,4r,5r)-5-(6-aminopurin-9-ium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl]-2-ethyl-blahcyclohexan-6-one |
Molecular Mass | 412.464 g·mol−1 |
Heat of Formation | -633.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.54 ± 1.08 D |
Volume | 457.31 Å 3 |
Surface Area | 367.63 Å 2 |
HOMO Energy | -8.76 ± 0.55 eV |
LUMO Energy | -0.87 ± eV |
Point Group Symmetry | C1 |
InChIKey | ZFKLRXWXKVQZJN-IXCNWUDHSA-O |
QR Code | Generate QR Code |
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Elements | H S C O N |