Information card for entry 7115257

Structure parameters

• Common name: Cd_BNP_KSCN_2941
• Chemical name: Bis-(2,2'-di(1,6-naphthyridine))-dithiocyanato-cadmium(II)
• Formula: C34 H20 Cd N10 S2
• Calculated formula: C34 H20 Cd N10 S2
• Title of publication: 2,2′-Bi-1,6-naphthyridine metal complexes: a new ligand and a novel 2 ×2 inclined interpenetration of (4,4) nets or formation of helicoidal chains†
• Authors of publication: Wu, He-Ping; Janiak, Christoph; Uehlin, Lars; Klüfers, Peter; Mayer, Peter
• Journal of publication: Chemical Communications
• Year of publication: 1998
• Journal issue: 23
• Pages of publication: 2637
• a: 21.9537 ± 0.0013 Å
• b: 16.027 ± 0.0011 Å
• c: 8.5477 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3007.5 ± 0.3 ų
• Cell temperature: 200 ± 3 K
• Ambient diffraction temperature: 200 ± 3 K
• Number of distinct elements: 5
• Space group number: 64
• Hermann-Mauguin space group symbol: C m c a
• Hall space group symbol: -C 2ac 2
• Residual factor for all reflections: 0.0262
• Residual factor for significantly intense reflections: 0.0235
• Weighted residual factors for significantly intense reflections: 0.0606
• Weighted residual factors for all reflections included in the refinement: 0.0616
• Goodness-of-fit parameter for all reflections included in the refinement: 1.091
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No