Information card for entry 7025186

Structure parameters

• Formula: C64 H84 Cl2 Mg4 N4 O P4 Si4
• Calculated formula: C64 H84 Cl2 Mg4 N4 O P4 Si4
• SMILES: c1(ccccc1)P1(c2ccccc2)=[N]([Si](C)(C)C)[Mg]23[O]4([Mg]([Cl]3)(CP(c3ccccc3)(c3ccccc3)=[N]([Si](C)(C)C)[Mg]43C1)[N](=P(C1)(c4ccccc4)c4ccccc4)[Si](C)(C)C)[Mg]1([Cl]3)[N](=P(C2)(c1ccccc1)c1ccccc1)[Si](C)(C)C
• Title of publication: Reactivity of Zn(II), Mg(II) and Al(III) chlorides with a phosphinimine ligand: new tetrameric inverse crown ether structures.
• Authors of publication: Valerio Cárdenas, Cintya; Muñoz Hernández, Miguel Angel; Grévy, Jean-Michel
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 28
• Pages of publication: 6441 - 6448
• a: 14.8622 ± 0.0016 Å
• b: 14.8622 ± 0.0016 Å
• c: 16.258 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3591.1 ± 0.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 114
• Hermann-Mauguin space group symbol: P -4 21 c
• Hall space group symbol: P -4 2n
• Residual factor for all reflections: 0.0457
• Residual factor for significantly intense reflections: 0.0417
• Weighted residual factors for significantly intense reflections: 0.0939
• Weighted residual factors for all reflections included in the refinement: 0.0957
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No