Information card for entry 7045450

Structure parameters

• Common name: 1DMSO
• Formula: C39 H70 Cl3 Co N13 O2 P4 Ru2 S2
• Calculated formula: C39 H70 Cl3 Co N13 O2 P4 Ru2 S2
• Title of publication: Water driven formation of channels: unusual solid-state structural transformation of a heterometallic polymer.
• Authors of publication: Scalambra, Franco; Serrano-Ruiz, Manuel; Romerosa, Antonio
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 10
• Pages of publication: 3588 - 3595
• a: 18.4888 ± 0.0013 Å
• b: 15.9993 ± 0.0012 Å
• c: 17.557 ± 0.0013 Å
• α: 90°
• β: 96.121 ± 0.001°
• γ: 90°
• Cell volume: 5163.9 ± 0.7 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 9
• 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: 0.0297
• Residual factor for significantly intense reflections: 0.0254
• Weighted residual factors for significantly intense reflections: 0.0562
• Weighted residual factors for all reflections included in the refinement: 0.0581
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No