Information card for entry 7028302

Structure parameters

• Formula: C41.5 H42 N2 Si2 Zn2
• Calculated formula: C41.5 H42 N2 Si2 Zn2
• SMILES: [Zn]1([NH]([Si](c2ccccc2)(c2ccccc2)c2ccccc2)[Zn]([NH]1[Si](c1ccccc1)(c1ccccc1)c1ccccc1)C)C.c1ccccc1C
• Title of publication: New organo- and amidozinc derivatives of primary amines.
• Authors of publication: Cosham, Samuel D.; Hill, Michael S.; Johnson, Andrew L.; Molloy, Kieran C.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 2
• Pages of publication: 859 - 864
• a: 26.284 ± 0.0003 Å
• b: 9.477 ± 0.0002 Å
• c: 32.319 ± 0.0004 Å
• α: 90°
• β: 110.277 ± 0.001°
• γ: 90°
• Cell volume: 7551.6 ± 0.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0731
• Residual factor for significantly intense reflections: 0.0489
• Weighted residual factors for significantly intense reflections: 0.1097
• Weighted residual factors for all reflections included in the refinement: 0.1294
• Goodness-of-fit parameter for all reflections included in the refinement: 1.014
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No