Information card for entry 2243485

Structure parameters

• Chemical name: <i>catena</i>-Poly[[[diaquabis(<i>N</i>-benzoylglycinato)cobalt(II)]-μ-aqua] dihydrate]
• Formula: C18 H26 Co N2 O11
• Calculated formula: C18 H26 Co N2 O11
• SMILES: [Co]([OH2])([OH2][Co]([OH2])(OC(=O)CNC(=O)c1ccccc1)([OH2])([OH2])OC(=O)CNC(=O)c1ccccc1)(OC(=O)CNC(=O)c1ccccc1)([OH2])OC(=O)CNC(=O)c1ccccc1.O.O.O.O
• Title of publication: Crystal structures of two isostructural bivalent metal <i>N</i>-benzoylglycinates
• Authors of publication: Narvekar, Kedar U.; Srinivasan, Bikshandarkoil R.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2020
• Journal volume: 76
• Journal issue: 8
• Pages of publication: 1260 - 1265
• a: 40.843 ± 0.002 Å
• b: 6.9072 ± 0.0004 Å
• c: 8.0031 ± 0.0004 Å
• α: 90°
• β: 91.891 ± 0.002°
• γ: 90°
• Cell volume: 2256.5 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0641
• Residual factor for significantly intense reflections: 0.0366
• Weighted residual factors for significantly intense reflections: 0.0702
• Weighted residual factors for all reflections included in the refinement: 0.086
• Goodness-of-fit parameter for all reflections included in the refinement: 1.082
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes