Information card for entry 2239672

Structure parameters

• Chemical name: Bis{<i>N</i>-[2-hydroxy-1,1-bis(hydroxymethyl)ethyl]glycinato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>'}iron(II)
• Formula: C12 H24 Fe N2 O10
• Calculated formula: C12 H24 Fe N2 O10
• SMILES: C1(CO)(CO)C[OH][Fe]234([NH]1CC(=O)O2)[NH](C(CO)(CO)C[OH]3)CC(=O)O4
• Title of publication: Bis{<i>N</i>-[2-hydroxy-1,1-bis(hydroxymethyl)ethyl]glycinato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>'}iron(II)
• Authors of publication: Jiang, Ning; Hou, Juan-Juan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 7
• Pages of publication: m274
• a: 8.8198 ± 0.0007 Å
• b: 9.0245 ± 0.0007 Å
• c: 12.3533 ± 0.0007 Å
• α: 90°
• β: 127.224 ± 0.004°
• γ: 90°
• Cell volume: 782.94 ± 0.11 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0726
• Residual factor for significantly intense reflections: 0.0457
• Weighted residual factors for significantly intense reflections: 0.0843
• Weighted residual factors for all reflections included in the refinement: 0.0993
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes