Information card for entry 2015347

Structure parameters

• Common name: [{Cu(phen)}~2~(tp)Mo~4~O~13~]~n~
• Chemical name: poly[di-μ~3~-oxo-hepta-μ~2~oxo-tetraoxobis(1,10-phenanthroline)-μ~4~- terephthalato-dicopper(II)tetramolybdate(VI)
• Formula: C32 H20 Cu2 Mo4 N4 O17
• Calculated formula: C32 H20 Cu2 Mo4 N4 O17
• Title of publication: An extended two-dimensional copper‒molybdate compound with mixed dicarboxyl and organodiamine ligands
• Authors of publication: Xiao-Yuan Wu; Quan-Guo Zhai; Li-Juan Chen; Can-Zhong Lu
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 6
• Pages of publication: m261 - m263
• a: 7.4592 ± 0.0017 Å
• b: 10.251 ± 0.002 Å
• c: 11.624 ± 0.003 Å
• α: 78.603 ± 0.005°
• β: 85.529 ± 0.007°
• γ: 83.151 ± 0.008°
• Cell volume: 863.7 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0227
• Residual factor for significantly intense reflections: 0.0198
• Weighted residual factors for significantly intense reflections: 0.0533
• Weighted residual factors for all reflections included in the refinement: 0.0543
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes