Information card for entry 7004705

Structure parameters

• Common name: [{Ru(tpyNHNCHpy)2}2Fe(NCS)2]An(NCS)2
• Formula: C116 H132 Fe3 N34 O13 Ru2 S10
• Calculated formula: C116 H121 Fe3 N34 O13 Ru2 S10
• Title of publication: Curly‒curly, loop‒loop: homoleptic metal(ii) complexes of pyridinecarbaldehyde 4′-(2,2′:6′,2″-terpyridyl)hydrazones and their coordination polymers
• Authors of publication: Beves, Jonathon E.; Constable, Edwin C.; Housecroft, Catherine E.; Kepert, Cameron J.; Neuburger, Markus; Price, David J.; Schaffner, Silvia; Zampese, Jennifer A.
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 47
• Pages of publication: 6742 - 6751
• a: 13.812 ± 0.008 Å
• b: 15.073 ± 0.008 Å
• c: 18.604 ± 0.01 Å
• α: 67.221 ± 0.008°
• β: 70.821 ± 0.008°
• γ: 73.834 ± 0.008°
• Cell volume: 3322 ± 3 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: 0.2173
• Residual factor for significantly intense reflections: 0.0822
• Weighted residual factors for significantly intense reflections: 0.1821
• Weighted residual factors for all reflections included in the refinement: 0.2416
• Goodness-of-fit parameter for all reflections included in the refinement: 0.926
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No