Information card for entry 7033463

Structure parameters

• Formula: C26 H38 O8 Pd2
• Calculated formula: C26 H38 O8 Pd2
• SMILES: CC1=[O][Pd]2(OC(=C1)C)OC(=C(C(=[O]2)C)C1=C(C)O[Pd]2([O]=C1CC(C)C)OC(=CC(=[O]2)C)C)CC(C)C
• Title of publication: Effects of auxiliary ligands of Pd(ii) dimers on induction of chiral nematic phases: chirality inversion and the photo-responsive structural change.
• Authors of publication: Tamura, Kenji; Yoshida, Jun; Taniguchi, Masahiro; Kitazawa, Takafumi; Yamagishi, Akihiko; Sato, Hisako
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 7
• Pages of publication: 3209 - 3215
• a: 11.1943 ± 0.001 Å
• b: 21.6804 ± 0.0019 Å
• c: 11.8179 ± 0.001 Å
• α: 90°
• β: 98.94 ± 0.001°
• γ: 90°
• Cell volume: 2833.3 ± 0.4 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.031
• Residual factor for significantly intense reflections: 0.028
• Weighted residual factors for significantly intense reflections: 0.0637
• Weighted residual factors for all reflections included in the refinement: 0.0651
• Goodness-of-fit parameter for all reflections included in the refinement: 1.158
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No