Information card for entry 2013835

Structure parameters

• Chemical name: (2,2'-Bipyridine-κ^2^N,N')(1,1-cyclobutanedicarboxylato- κ^2^O,O')palladium(II)
• Formula: C16 H14 N2 O4 Pd
• Calculated formula: C16 H14 N2 O4 Pd
• SMILES: [Pd]12([n]3c(c4[n]2cccc4)cccc3)OC(=O)C2(C(=O)O1)CCC2
• Title of publication: (2,2'-Bipyridine-κ^2^<i>N</i>,<i>N</i>')(1,1-cyclobutanedicarboxylato-κ^2^<i>O</i>,<i>O</i>')palladium(II), (1,1-cyclobutanedicarboxylato-κ^2^<i>O</i>,<i>O</i>')(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')palladium(II) monohydrate and (1,1-cyclobutanedicarboxylato-κ^2^<i>O</i>,<i>O</i>')(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')palladium(II) dihydrate
• Authors of publication: Muranishi, Yasunori; Okabe, Nobuo
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 2
• Pages of publication: m47 - m50
• a: 9.087 ± 0.001 Å
• b: 9.44 ± 0.001 Å
• c: 9.982 ± 0.0009 Å
• α: 90.458 ± 0.009°
• β: 113.095 ± 0.009°
• γ: 111.077 ± 0.009°
• Cell volume: 723.78 ± 0.15 ų
• Cell temperature: 296.2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.0215
• Weighted residual factors for all reflections included in the refinement: 0.0572
• Goodness-of-fit parameter for all reflections included in the refinement: 1.3
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No