Information card for entry 7212808

Structure parameters

• Formula: C34 H26 Fe N8 O4 S2
• Calculated formula: C34 H26 Fe N8 O4 S2
• Title of publication: The two-dimensional iron(ii)‒thiocyanate‒4,4′-bipyridine coordination network
• Authors of publication: Adams, Christopher J.; Real, José Antonio; Waddington, Rachel E.
• Journal of publication: CrystEngComm
• Year of publication: 2010
• Journal volume: 12
• Journal issue: 11
• Pages of publication: 3547
• a: 22.471 ± 0.006 Å
• b: 11.605 ± 0.003 Å
• c: 13.205 ± 0.003 Å
• α: 90°
• β: 103.083 ± 0.015°
• γ: 90°
• Cell volume: 3354.2 ± 1.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0441
• Residual factor for significantly intense reflections: 0.0325
• Weighted residual factors for significantly intense reflections: 0.072
• Weighted residual factors for all reflections included in the refinement: 0.0776
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No