Information card for entry 4319098

Structure parameters

• Formula: C10 H8 Cl4 Cu6 N6
• Calculated formula: C10 H8 Cl4 Cu6 N6
• Title of publication: Hydrothermal Syntheses, Structures, and Properties of [Cu3Cl2CN(pyrazine)] and Copper(I) Halide Pyrazine Polymers
• Authors of publication: Nicole S. Persky; Jessica M. Chow; Karalee A. Poschmann; Nanette N. Lacuesta; Sarah L. Stoll; Simon G. Bott; Steven Obrey
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 29 - 35
• a: 3.635 ± 0.0007 Å
• b: 17.16 ± 0.003 Å
• c: 6.98 ± 0.0014 Å
• α: 90°
• β: 90.58 ± 0.03°
• γ: 90°
• Cell volume: 435.37 ± 0.14 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0656
• Residual factor for significantly intense reflections: 0.0591
• Weighted residual factors for all reflections: 0.1821
• Weighted residual factors for significantly intense reflections: 0.1659
• Goodness-of-fit parameter for all reflections: 1.046
• Goodness-of-fit parameter for significantly intense reflections: 1.096
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No