Information card for entry 4332609

Structure parameters

• Formula: C31 H32 Cr2 N2 O13 Pb
• Calculated formula: C31 H32 Cr2 N2 O13 Pb
• SMILES: C([Cr](C#[O])(C#[O])(C#[O])(C#[O])[Pb]1(OC(=O)O1)[Cr](C#[O])(C#[O])(C#[O])(C#[O])C#[O])#[O].c1(ccccc1)C[N+](C)(C)C.c1(ccccc1)C[N+](C)(C)C
• Title of publication: Carbon Dioxide Fixation by an Unprecedented Hydroxo Lead−Chromium Carbonyl Complex: Synthesis, Reactivity, and Theoretical Calculations
• Authors of publication: Hsu, Miao-Hsing; Chen, Rung-Tsang; Sheu, Wen-Shyan; Shieh, Minghuey
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 17
• Pages of publication: 6740 - 6747
• a: 12.088 ± 0.008 Å
• b: 23.971 ± 0.0011 Å
• c: 12.832 ± 0.005 Å
• α: 90°
• β: 90.49 ± 0.04°
• γ: 90°
• Cell volume: 3718 ± 3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• 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: 0.1615
• Residual factor for significantly intense reflections: 0.0471
• Weighted residual factors for significantly intense reflections: 0.1077
• Weighted residual factors for all reflections included in the refinement: 0.1424
• Goodness-of-fit parameter for all reflections included in the refinement: 0.984
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mokα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No