Information card for entry 7109355

Structure parameters

• Common name: AlaZnCl
• Formula: C9 H15 Cl N2 O4 Zn
• Calculated formula: C9 H11 Cl N2 O4 Zn
• Title of publication: Salt metathesis in three dimensional metal-organic frameworks (MOFs) with unprecedented hydrolytic regenerability
• Authors of publication: Tanay Kundu; Subash C. Sahoo; Subhadeep Saha; Rahul Banerjee
• Journal of publication: Chem.Commun.
• Year of publication: 2013
• Journal volume: 49
• Pages of publication: 5262
• a: 17.4587 ± 0.0002 Å
• b: 17.4587 ± 0.0002 Å
• c: 10.24475 ± 0.00014 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 2704.31 ± 0.06 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 169
• Hermann-Mauguin space group symbol: P 61
• Hall space group symbol: P 61
• Residual factor for all reflections: 0.0436
• Residual factor for significantly intense reflections: 0.042
• Weighted residual factors for significantly intense reflections: 0.1237
• Weighted residual factors for all reflections included in the refinement: 0.1253
• Goodness-of-fit parameter for all reflections included in the refinement: 1.142
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No