Information card for entry 7005277

Structure parameters

• Common name: catena-bis(mu4-5-(pyrimidil)tetrazolate)-cadmium(ii)
• Chemical name: catena-bis(mu4-5-(pyrimidil)tetrazolate)-cadmium(ii)
• Formula: C10 H6 Cd N12
• Calculated formula: C10 H6 Cd N12
• Title of publication: Synthesis, X-ray structures and luminescence properties of three multidimensional metal-organic frameworks incorporating the versatile 5-(pyrimidyl)tetrazolato bridging ligand.
• Authors of publication: Rodríguez-Diéguez, A; Salinas-Castillo, A; Galli, S.; Masciocchi, N.; M Gutiérrez-Zorrilla, J; Vitoria, P.; Colacio, E.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 18
• Pages of publication: 1821 - 1828
• a: 9.0559 ± 0.0003 Å
• b: 9.0559 ± 0.0003 Å
• c: 15.78 ± 0.0013 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1294.11 ± 0.12 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 134
• Hermann-Mauguin space group symbol: P 42/n n m :2
• Hall space group symbol: -P 4ac 2bc
• Residual factor for all reflections: 0.0225
• Residual factor for significantly intense reflections: 0.0202
• Weighted residual factors for significantly intense reflections: 0.0561
• Weighted residual factors for all reflections included in the refinement: 0.0585
• Goodness-of-fit parameter for all reflections included in the refinement: 1.169
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No