Information card for entry 7014381

Structure parameters

• Formula: C18 H52 Mg N4 P2 S2 Si4
• Calculated formula: C18 H52 Mg N4 P2 S2 Si4
• SMILES: C[Si](C)(C)[N]1[Mg]2([N](=S1CP(C)C)[Si](C)(C)C)[N](=S(CP(C)C)N2[Si](C)(C)C)[Si](C)(C)C
• Title of publication: Access to new Janus head ligands: linking sulfur diimides and phosphanes for hemilabile tripodal scorpionates.
• Authors of publication: Meinholz, Margret M.; Pandey, Sushil K.; Deuerlein, Stephan M.; Stalke, Dietmar
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 8
• Pages of publication: 1662 - 1671
• a: 10.2563 ± 0.0005 Å
• b: 17.8142 ± 0.0008 Å
• c: 19.2917 ± 0.0009 Å
• α: 90°
• β: 99.273 ± 0.001°
• γ: 90°
• Cell volume: 3478.7 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• 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: 0.0238
• Residual factor for significantly intense reflections: 0.0213
• Weighted residual factors for significantly intense reflections: 0.0612
• Weighted residual factors for all reflections included in the refinement: 0.063
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No