Information card for entry 2018979

Structure parameters

• Chemical name: <i>rac</i>-Bis{μ-<i>trans</i>-2,2'-[pentane-1,5-diylbis(azanediyl)]ditroponato}dipalladium(II)
• Formula: C38 H40 N4 O4 Pd2
• Calculated formula: C38 H40 N4 O4 Pd2
• SMILES: C12C(C=CC=CC=1)=[N]1[Pd]3(O2)[N](=C2C(O3)=CC=CC=C2)CCCCC[N]2=C3C(O[Pd]42[N](=C2C(O4)=CC=CC=C2)CCCCC1)=CC=CC=C3
• Title of publication: A clothes-peg-shaped binuclear <i>trans</i>-bis(2-aminotroponato)palladium(II) complex bearing pentamethylene spacers
• Authors of publication: Komiya, Naruyoshi; Kageyama, Takeharu; Naito, Masaya; Naota, Takeshi
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 5
• Pages of publication: 503 - 505
• a: 16.282 ± 0.003 Å
• b: 17.74 ± 0.003 Å
• c: 11.608 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3352.9 ± 1 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 5
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for significantly intense reflections: 0.0214
• Weighted residual factors for all reflections included in the refinement: 0.0555
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes