Information card for entry 2242630

Structure parameters

• Chemical name: Poly[(benzene-1,2-diamine)(μ~5~-phosphonato)zinc]
• Formula: C6 H9 N2 O3 P Zn
• Calculated formula: C6 H9 N2 O3 P Zn
• Title of publication: Template or ligand? Different structural behaviours of aromatic amines in combination with zincophosphite networks
• Authors of publication: Holmes, William; Cordes, David B.; Slawin, Alexandra M. Z.; Harrison, William T. A.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2018
• Journal volume: 74
• Journal issue: 10
• Pages of publication: 1411 - 1416
• a: 8.0419 ± 0.0002 Å
• b: 13.5008 ± 0.0004 Å
• c: 8.1307 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 882.77 ± 0.04 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.0229
• Residual factor for significantly intense reflections: 0.0218
• Weighted residual factors for significantly intense reflections: 0.0509
• Weighted residual factors for all reflections included in the refinement: 0.0513
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes