Information card for entry 2011589

Structure parameters

• Formula: C18 H36 Cr N10 O8 Pr
• Calculated formula: C18 H36 Cr N10 O8 Pr
• SMILES: [Pr]([O]=CN(C)C)([OH2])([OH2])([OH2])([N]#C[Cr](C#N)(C#N)(C#N)(C#N)C#N)([O]=CN(C)C)([O]=CN(C)C)[O]=CN(C)C.O
• Title of publication: A cyanide-bridged bimetallic complex, [CrPr(CN)~6~(C~3~H~7~NO)~4~(H~2~O)~3~]·H~2~O
• Authors of publication: Combs, Robert A.; Farmer, J. Matt; Kautz, Jason A.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2000
• Journal volume: 56
• Journal issue: 12
• Pages of publication: 1420 - 1422
• a: 17.94 ± 0.003 Å
• b: 8.9381 ± 0.0008 Å
• c: 19.8691 ± 0.0016 Å
• α: 90°
• β: 96.121 ± 0.01°
• γ: 90°
• Cell volume: 3167.8 ± 0.7 ų
• Cell temperature: 186 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0306
• Residual factor for significantly intense reflections: 0.0266
• Weighted residual factors for all reflections included in the refinement: 0.0706
• Goodness-of-fit parameter for all reflections included in the refinement: 1.097
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes