Information card for entry 4342074

Structure parameters

• Formula: C23 H33 N7 S2 Sr
• Calculated formula: C23 H33 N7 S2 Sr
• SMILES: [Sr]1234([n]5n1c(cc5)c1sccc1)([n]1n2c(cc1)c1sccc1)[N](C)(C)CC[N]3(C)CC[N]4(C)C
• Title of publication: Tris(pyrazolyl)methanides of the Alkaline Earth Metals: Influence of the Substitution Pattern on Stability and Degradation.
• Authors of publication: Müller, Christoph; Koch, Alexander; Görls, Helmar; Krieck, Sven; Westerhausen, Matthias
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 2
• Pages of publication: 635 - 645
• a: 9.6974 ± 0.0003 Å
• b: 7.794 ± 0.0003 Å
• c: 17.8919 ± 0.0005 Å
• α: 90°
• β: 100.821 ± 0.002°
• γ: 90°
• Cell volume: 1328.25 ± 0.08 ų
• Cell temperature: 133 ± 2 K
• Ambient diffraction temperature: 133 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0437
• Residual factor for significantly intense reflections: 0.0414
• Weighted residual factors for significantly intense reflections: 0.0982
• Weighted residual factors for all reflections included in the refinement: 0.0999
• Goodness-of-fit parameter for all reflections included in the refinement: 0.805
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No