Information card for entry 7046477

Structure parameters

• Formula: C42 H52 Cl2 Cu2 N4 Se2
• Calculated formula: C42 H52 Cl2 Cu2 N4 Se2
• Title of publication: Coinage metal complexes of selenoureas derived from N-heterocyclic carbenes.
• Authors of publication: Nahra, Fady; Van Hecke, Kristof; Kennedy, Alan R.; Nelson, David J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 31
• Pages of publication: 10671 - 10684
• a: 14.339 ± 0.0005 Å
• b: 14.7102 ± 0.0007 Å
• c: 21.2622 ± 0.0008 Å
• α: 90°
• β: 103.538 ± 0.004°
• γ: 90°
• Cell volume: 4360.2 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• 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: 0.1127
• Residual factor for significantly intense reflections: 0.0556
• Weighted residual factors for significantly intense reflections: 0.0907
• Weighted residual factors for all reflections included in the refinement: 0.1106
• 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