Information card for entry 2236137

Structure parameters

• Chemical name: Bis(2,2':6',2''-terpyridine)ruthenium(II) bis(perchlorate) hemihydrate
• Formula: C30 H23 Cl2 N6 O8.5 Ru
• Calculated formula: C30 H23 Cl2 N6 O8.5 Ru
• Title of publication: Bis(2,2':6',2''-terpyridine)ruthenium(II) bis(perchlorate) hemihydrate
• Authors of publication: Kozlowska, Mariana; Rodziewicz, Pawel; Brus, Diana Malgorzata; Breczko, Joanna; Brzezinski, Krzysztof
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 11
• Pages of publication: m1414 - m1415
• a: 8.7676 ± 0.0002 Å
• b: 8.8221 ± 0.0009 Å
• c: 39.118 ± 0.004 Å
• α: 90°
• β: 93.582 ± 0.005°
• γ: 90°
• Cell volume: 3019.8 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0451
• Residual factor for significantly intense reflections: 0.0423
• Weighted residual factors for significantly intense reflections: 0.0812
• Weighted residual factors for all reflections included in the refinement: 0.0826
• Goodness-of-fit parameter for all reflections included in the refinement: 1.272
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes