Information card for entry 7003025

Structure parameters

• Formula: C32 H66 N8 O4 Pd
• Calculated formula: C32 H66 N8 O4 Pd
• SMILES: C1(C(=N([Pd]2([N]=1O)[N](=C(C(=N2=O)NCCCCCCC)NCCCCCCC)O)=O)NCCCCCCC)NCCCCCCC
• Title of publication: Channel architecture via self assembly of oxamide oximes complexes
• Authors of publication: Yuksel, Fatma; Gümüş, Gülay; Gürol, İlke; Ahsen, Vefa; Chumakov, Yurii; Jeanneau, Erwann; Luneau, Dominique
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 2
• Pages of publication: 241 - 252
• a: 17.4724 ± 0.0004 Å
• b: 17.4724 ± 0.0004 Å
• c: 26.4145 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8063.9 ± 0.4 ų
• Cell temperature: 130 K
• Ambient diffraction temperature: 130 K
• Number of distinct elements: 5
• Space group number: 88
• Hermann-Mauguin space group symbol: I 41/a :2
• Hall space group symbol: -I 4ad
• Residual factor for all reflections: 0.0967
• Residual factor for significantly intense reflections: 0.0471
• Weighted residual factors for all reflections: 0.0725
• Weighted residual factors for significantly intense reflections: 0.0465
• Weighted residual factors for all reflections included in the refinement: 0.0465
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1258
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No