Information card for entry 4074979

Structure parameters

• Chemical name: Hexa-(mu-Chloro)-bi-(mu3-Chloro)- mu-hapto5-Pentamethylcyclopentadienyl- tetrakis(hapto5-pentamethylcyclopentadienyl) hexamagnesat- bis(hapto5-pentamethylcyclopentadienyl)aluminocenium
• Formula: C76 H111 Al Cl8 Mg6
• Calculated formula: C76 H111 Al Cl8 Mg6
• Title of publication: The Anion [Mg6Cl8Cp*5]-: A Final Intermediate on the Way to the Molecular Donor-Free Grignard Compound MgClCp*?
• Authors of publication: Vollet, Jean; Hartig, Jens R.; Baranowska, Katarzyna; Schnöckel, Hansgeorg
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 8
• Pages of publication: 2101
• a: 15.7808 ± 0.001 Å
• b: 16.3514 ± 0.0013 Å
• c: 16.6649 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4300.2 ± 0.5 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• Space group number: 18
• Hermann-Mauguin space group symbol: P 21 21 2
• Hall space group symbol: P 2 2ab
• Residual factor for all reflections: 0.0875
• Residual factor for significantly intense reflections: 0.0457
• Weighted residual factors for significantly intense reflections: 0.1156
• Weighted residual factors for all reflections included in the refinement: 0.1356
• Goodness-of-fit parameter for all reflections included in the refinement: 0.897
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No