Information card for entry 2215628

Structure parameters

• Chemical name: Bromido[(1,2,5,6-η)-1,3,5,7-cyclooctatetraene]methylplatinum(II)
• Formula: C9 H11 Br Pt
• Calculated formula: C9 H11 Br Pt
• SMILES: [Pt]123(Br)([CH]4=[CH]1C=C[CH]2=[CH]3C=C4)C
• Title of publication: Bromido[(1,2,5,6-η)-1,3,5,7-cyclooctatetraene]methylplatinum(II)
• Authors of publication: Song, Ah-Ran; Hwang, In-Chul; Ha, Kwang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 10
• Pages of publication: m2484 - m2484
• a: 8.3637 ± 0.0012 Å
• b: 10.1098 ± 0.0015 Å
• c: 11.6897 ± 0.0017 Å
• α: 90°
• β: 97.928 ± 0.003°
• γ: 90°
• Cell volume: 979 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0786
• Residual factor for significantly intense reflections: 0.0573
• Weighted residual factors for significantly intense reflections: 0.1674
• Weighted residual factors for all reflections included in the refinement: 0.1756
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes