Information card for entry 7026081

Structure parameters

• Formula: C39 H56 I2 N2 O2 P2 Si2 Zn
• Calculated formula: C39 H56 I2 N2 O2 P2 Si2 Zn
• SMILES: C1P(c2ccccc2)(c2ccccc2)=[N]([Si](C)(C)C)[Zn]([N]([Si](C)(C)C)=P1(c1ccccc1)c1ccccc1)(I)I.C1CCCO1.C1CCCO1
• Title of publication: Bis(phosphinimino)methanides as non-innocent ligand in zinc chemistry: synthesis and structures.
• Authors of publication: Marks, Sebastian; Panda, Tarun K.; Roesky, Peter W.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 31
• Pages of publication: 7230 - 7235
• a: 11.523 ± 0.002 Å
• b: 22.951 ± 0.005 Å
• c: 16.995 ± 0.003 Å
• α: 90°
• β: 91.95 ± 0.03°
• γ: 90°
• Cell volume: 4492 ± 1.5 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 2 K
• Number of distinct elements: 8
• 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: 0.0827
• Residual factor for significantly intense reflections: 0.0462
• Weighted residual factors for significantly intense reflections: 0.1016
• Weighted residual factors for all reflections included in the refinement: 0.1135
• Goodness-of-fit parameter for all reflections included in the refinement: 0.899
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No