Information card for entry 2216272

Structure parameters

• Chemical name: Poly[(R)-2-methylpiperazinediium [μ~3~-chlorido-μ~2~-chlorido-dichloridodicopper(I)]]
• Formula: C5 H14 Cl4 Cu2 N2
• Calculated formula: C5 H14 Cl4 Cu2 N2
• SMILES: [Cu]12(Cl)([Cu]([Cl]1)Cl)[Cl][Cu]1(Cl)[Cu]3(Cl)([Cl]1)[Cl]2[Cu]1(Cl)[Cu]2([Cl]1)(Cl)[Cl]3[Cu]1(Cl)[Cu](Cl)([Cl]1)[Cl]2.[NH2+]1[C@H](C)C[NH2+]CC1.[NH2+]1[C@H](C)C[NH2+]CC1.[NH2+]1[C@H](C)C[NH2+]CC1.[NH2+]1[C@H](C)C[NH2+]CC1
• Title of publication: Poly[(<i>R</i>)-2-methylpiperazinediium [μ~3~-chlorido-μ~2~-chlorido-dichloridodicopper(I)]]
• Authors of publication: Luo, Hui-Zhou; Ye, Heng-Yun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 12
• Pages of publication: m2884 - m2884
• a: 6.1943 ± 0.0016 Å
• b: 12.544 ± 0.004 Å
• c: 15.561 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1209.1 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0475
• Residual factor for significantly intense reflections: 0.0396
• Weighted residual factors for significantly intense reflections: 0.0866
• Weighted residual factors for all reflections included in the refinement: 0.0911
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes