Information card for entry 7052541

Structure parameters

• Common name: Compound X
• Formula: C40 H58 Cl2 O6 P2 Pd Si2
• Calculated formula: C40 H58 Cl2 O6 P2 Pd Si2
• Title of publication: Synthesis of mesoporous metal complex-silica materials and their use as solvent-free catalysts
• Authors of publication: Linares, Noemi; Sepúlveda, Angel E.; Pacheco, María C.; Berenguer, Jesús R.; Lalinde, Elena; Nájera, Carmen; Garcia-Martinez, Javier
• Journal of publication: New Journal of Chemistry
• Year of publication: 2011
• Journal volume: 35
• Journal issue: 1
• Pages of publication: 225
• a: 9.248 ± 0.0004 Å
• b: 11.408 ± 0.0007 Å
• c: 11.721 ± 0.0008 Å
• α: 76.248 ± 0.003°
• β: 71.031 ± 0.004°
• γ: 78.739 ± 0.003°
• Cell volume: 1126.49 ± 0.12 ų
• Cell temperature: 120 ± 1 K
• Ambient diffraction temperature: 120 ± 1 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0538
• Residual factor for significantly intense reflections: 0.0378
• Weighted residual factors for significantly intense reflections: 0.078
• Weighted residual factors for all reflections included in the refinement: 0.0839
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No