Information card for entry 7009773

Structure parameters

• Common name: Cu(dca)(tmp)0.5
• Chemical name: Cuprous dicyanamide hemi(tetramethylpyrazine)
• Formula: C6 H6 Cu N4
• Calculated formula: C6 H6 Cu N4
• Title of publication: Copper(I) dicyanamide coordination polymers: ladders, sheets, layers, diamond-like networks and unusual interpenetration †
• Authors of publication: Batten, Stuart R.; Harris, Alexander R.; Jensen, Paul; Murray, Keith S.; Ziebell, Angela
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 21
• Pages of publication: 3829
• a: 3.8969 ± 0.0001 Å
• b: 18.5279 ± 0.0009 Å
• c: 9.9978 ± 0.0005 Å
• α: 90°
• β: 92.039 ± 0.003°
• γ: 90°
• Cell volume: 721.4 ± 0.05 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0529
• Residual factor for significantly intense reflections: 0.0335
• Weighted residual factors for significantly intense reflections: 0.0549
• Weighted residual factors for all reflections included in the refinement: 0.0594
• Goodness-of-fit parameter for all reflections included in the refinement: 1.089
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No