Information card for entry 7105192

Structure parameters

• Formula: C74 H102 Fe2 N6 O9 Sn2
• Calculated formula: C74 H102 Fe2 N6 O9 Sn2
• SMILES: [Sn]1([Fe](C#[O])(C#[O])(C#[O])C#[O])(N(C)C)N(C(=CC(=[N]1c1c(cccc1C(C)C)C(C)C)C)C)c1c(cccc1C(C)C)C(C)C.O1CCCC1
• Title of publication: A rational design for an efficient synthesis of a monomeric tin(II) hydroxide.
• Authors of publication: Jana, Anukul; Sarish, Sankaranarayana Pillai; Roesky, Herbert W; Schulzke, Carola; Samuel, Prinson P
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2010
• Journal volume: 46
• Journal issue: 5
• Pages of publication: 707 - 709
• a: 17.298 ± 0.004 Å
• b: 20.371 ± 0.004 Å
• c: 21.502 ± 0.004 Å
• α: 90°
• β: 94.33 ± 0.03°
• γ: 90°
• Cell volume: 7555 ± 3 ų
• Cell temperature: 133 ± 2 K
• Ambient diffraction temperature: 133 ± 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: 0.0411
• Residual factor for significantly intense reflections: 0.0316
• Weighted residual factors for significantly intense reflections: 0.0835
• Weighted residual factors for all reflections included in the refinement: 0.0863
• Goodness-of-fit parameter for all reflections included in the refinement: 1.13
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No