Information card for entry 7215048

Structure parameters

• Formula: C24 H22 N4 O6 Zn
• Calculated formula: C24 H22 N4 O6 Zn
• SMILES: C(=O)(c1cc(c(cc1)N)O)O[Zn]([n]1ccccc1)([n]1ccccc1)OC(=O)c1cc(c(cc1)N)O
• Title of publication: Functionalized aminocarboxylate moieties as linkers for coordination polymers: influence of the substituents in the dimensionality of the final structure
• Authors of publication: Fernández-Palacio, Francisco; Restrepo, Jimmy; Gálvez, Santos; Gómez-Sal, Pilar; Mosquera, Marta E. G.
• Journal of publication: CrystEngComm
• Year of publication: 2014
• Journal volume: 16
• Journal issue: 16
• Pages of publication: 3376
• a: 7.933 ± 0.002 Å
• b: 13.2295 ± 0.0017 Å
• c: 22.388 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2349.6 ± 0.8 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.1176
• Residual factor for significantly intense reflections: 0.0514
• Weighted residual factors for significantly intense reflections: 0.108
• Weighted residual factors for all reflections included in the refinement: 0.1417
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No