Information card for entry 2234725

Structure parameters

• Chemical name: Di-μ-bromido-bis({2-[(4,6-dimethylpyrimidin-2-yl)disulfanyl]-4,6- dimethylpyrimidine-κ^2^<i>N</i>^1^,<i>S</i>^2^}copper(I))
• Formula: C24 H28 Br2 Cu2 N8 S4
• Calculated formula: C24 H28 Br2 Cu2 N8 S4
• SMILES: [Br]1[Cu]23([n]4c(S[S]2c2nc(C)cc(n2)C)nc(cc4C)C)[Br][Cu]213[n]1c(nc(cc1C)C)S[S]2c1nc(cc(C)n1)C
• Title of publication: Di-μ-bromido-bis({2-[(4,6-dimethylpyrimidin-2-yl)disulfanyl]-4,6-dimethylpyrimidine-κ^2^<i>N</i>^1^,<i>S</i>^2^}copper(I))
• Authors of publication: Nimthong, Ruthairat; Pakawatchai, Chaveng; Wattanakanjana, Yupa
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 5
• Pages of publication: m645
• a: 15.3351 ± 0.0007 Å
• b: 15.3898 ± 0.0007 Å
• c: 14.3398 ± 0.0007 Å
• α: 90°
• β: 109.178 ± 0.001°
• γ: 90°
• Cell volume: 3196.4 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.0347
• Residual factor for significantly intense reflections: 0.0282
• Weighted residual factors for significantly intense reflections: 0.0733
• Weighted residual factors for all reflections included in the refinement: 0.0769
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes