Information card for entry 7703847

Structure parameters

• Formula: C20 H12 Fe N8 Pt
• Calculated formula: C20 H12 Fe N8 Pt
• Title of publication: Spin crossover in 2D iron(ii) phthalazine cyanometallic complexes.
• Authors of publication: Hiiuk, Volodymyr M.; Shova, Sergiu; Rotaru, Aurelian; Golub, Alexander A.; Fritsky, Igor O.; Gural'skiy, Il'ya A.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 16
• Pages of publication: 5302 - 5311
• a: 7.1262 ± 0.0005 Å
• b: 7.1724 ± 0.0005 Å
• c: 10.1727 ± 0.0008 Å
• α: 71.02 ± 0.007°
• β: 75.175 ± 0.006°
• γ: 89.95 ± 0.006°
• Cell volume: 473.38 ± 0.07 ų
• Cell temperature: 200 ± 0.14 K
• Ambient diffraction temperature: 200 ± 0.14 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0371
• Residual factor for significantly intense reflections: 0.0366
• Weighted residual factors for significantly intense reflections: 0.0765
• Weighted residual factors for all reflections included in the refinement: 0.0771
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No