Information card for entry 4329811

Structure parameters

• Formula: C20 H18 Cl2 Cu N12 O11 Se4
• Calculated formula: C20 H18 Cl2 Cu N12 O11 Se4
• Title of publication: Selenadiazolopyridine: A Synthon for Supramolecular Assembly and Complexes with Metallophilic Interactions
• Authors of publication: Goutam Mukherjee; Puspendra Singh; Chandrasekhar Ganguri; Sagar Sharma; Harkesh B. Singh; Nidhi Goel; Udai P. Singh; Ray J. Butcher
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 8128 - 8140
• a: 11.2674 ± 0.0007 Å
• b: 11.4607 ± 0.0008 Å
• c: 13.3644 ± 0.0008 Å
• α: 100.188 ± 0.004°
• β: 96.877 ± 0.003°
• γ: 106.36 ± 0.003°
• Cell volume: 1603.31 ± 0.18 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0729
• Residual factor for significantly intense reflections: 0.0338
• Weighted residual factors for significantly intense reflections: 0.0664
• Weighted residual factors for all reflections included in the refinement: 0.0763
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No