Information card for entry 7101753

Structure parameters

• Formula: C34 H53 Ga O Sr
• Calculated formula: C34 H53 Ga O Sr
• SMILES: [c]12([c]3([c]4([c]5([c]1(C)[Sr]16782345([c]2([c]1([c]6([c]7([c]82C)C)C)C)C)([O]1CCCC1)[Ga]1234[c]5([c]1([c]2([c]3([c]45C)C)C)C)C)C)C)C)C
• Title of publication: Gallium(I)-alkaline earth metal donor-acceptor bonds.
• Authors of publication: Wiecko, Michal; Roesky, Peter W; Nava, Paola; Ahlrichs, Reinhart; Konchenko, Sergey N
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2007
• Journal issue: 9
• Pages of publication: 927 - 929
• a: 16.0817 ± 0.0016 Å
• b: 22.922 ± 0.003 Å
• c: 18.5487 ± 0.0015 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6837.4 ± 1.2 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0754
• Residual factor for significantly intense reflections: 0.0474
• Weighted residual factors for significantly intense reflections: 0.0952
• Weighted residual factors for all reflections included in the refinement: 0.1051
• Goodness-of-fit parameter for all reflections included in the refinement: 1.006
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No