Information card for entry 8104786

Structure parameters

• Chemical name: <i>catena</i>-[(1,4,8,11-Tetraazacyclotetradecane-κ^4^<i>N,N',N'',N'''</i>)- bis(μ~2~-thiocyanato-<i>S,N</i>)-bis(thiocyanato-κ<i>S</i>)-nickel(II)- palladium(II)]
• Formula: C14 H24 N8 Ni Pd S4
• Calculated formula: C14 H24 N8 Ni Pd S4
• Title of publication: Crystal structure of catena-poly[(1,4,8,11-tetraazacyclotetradecane-κ 4 N,N′,N″,N′′′)-bis(μ 2-thiocyanato-κ2 N:S)-bis(thiocyanato-κS)-nickel(II)palladium(II)], C14H24N8NiPdS4
• Authors of publication: Ha, Kwang
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2021
• Journal volume: 236
• Journal issue: 3
• Pages of publication: 631 - 633
• a: 12.033 ± 0.0008 Å
• b: 12.0959 ± 0.0008 Å
• c: 15.9551 ± 0.0012 Å
• α: 85.768 ± 0.003°
• β: 71.917 ± 0.003°
• γ: 87.899 ± 0.003°
• Cell volume: 2201.3 ± 0.3 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0446
• Residual factor for significantly intense reflections: 0.0379
• Weighted residual factors for significantly intense reflections: 0.0905
• Weighted residual factors for all reflections included in the refinement: 0.0973
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No