Information card for entry 2015498

Structure parameters

• Chemical name: di-μ-chloro-bis[chloro(η^6^-p-cymene)ruthenium]‒9H-carbazole (1/2)
• Formula: C44 H46 Cl4 N2 Ru2
• Calculated formula: C44 H46 Cl4 N2 Ru2
• SMILES: [c]12([cH]3[cH]4[c]5([cH]6[cH]1[Ru]123456(Cl)[Cl][Ru]23456([c]7([cH]2[cH]3[c]4([cH]5[cH]67)C)C(C)C)([Cl]1)Cl)C)C(C)C.[nH]1c2ccccc2c2c1cccc2.[nH]1c2ccccc2c2ccccc12
• Title of publication: A μ-chloro-bridged dinuclear ruthenium complex with 9<i>H</i>-carbazole: the formation of one-dimensional linear chains of star-shaped edge-fused rings
• Authors of publication: Dinçer, Muharrem; Özdemir, Namık; Dayan, Osman; Çetinkaya, Bekir; Büyükgüngör, Orhan
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 8
• Pages of publication: m346 - m348
• a: 8.1427 ± 0.0005 Å
• b: 18.3212 ± 0.0014 Å
• c: 27.303 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4073.2 ± 0.6 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0551
• Residual factor for significantly intense reflections: 0.0314
• Weighted residual factors for significantly intense reflections: 0.0679
• Weighted residual factors for all reflections included in the refinement: 0.0725
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No