Information card for entry 2014937

Structure parameters

• Common name: Strontium di(hydrogen-L-glutamate) pentahydrate
• Chemical name: Strontium di(hydrogen-L-glutamate) pentahydrate
• Formula: C10 H26 N2 O13 Sr
• Calculated formula: C10 H26 N2 O13 Sr
• SMILES: [Sr]([OH2])([OH2])[OH2].[O-]C(=O)CC[C@H]([NH3+])C(=O)[O-].O.O.O=C([O-])[C@@H]([NH3+])CCC(=O)[O-]
• Title of publication: Strontium <small>D</small>-glutamate hexahydrate and strontium di(hydrogen <small>L</small>-glutamate) pentahydrate
• Authors of publication: Stephan Christgau; Jette Odderhede; Kenny Stahl; Jens E. T. Andersen
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 6
• Pages of publication: m259 - m262
• a: 8.7097 ± 0.0005 Å
• b: 7.245 ± 0.0004 Å
• c: 14.5854 ± 0.0008 Å
• α: 90°
• β: 100.521 ± 0.001°
• γ: 90°
• Cell volume: 904.89 ± 0.09 ų
• Cell temperature: 117 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.029
• Residual factor for significantly intense reflections: 0.0256
• Weighted residual factors for significantly intense reflections: 0.0528
• Weighted residual factors for all reflections included in the refinement: 0.0536
• Goodness-of-fit parameter for all reflections included in the refinement: 0.794
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes