Information card for entry 4100247

Structure parameters

• Formula: C10 H20 N4 O8
• Calculated formula: C10 H20 N4 O8
• SMILES: c1[nH+]c(c[nH]1)C[C@@H](C(=O)N[C@H](C(=O)[O-])CC(=O)[O-])[NH3+].O.O.O
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2005
• a: 4.8451 ± 0.0018 Å
• b: 18.326 ± 0.007 Å
• c: 8.678 ± 0.003 Å
• α: 90°
• β: 104.029 ± 0.007°
• γ: 90°
• Cell volume: 747.5 ± 0.5 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No