Information card for entry 7046829

Structure parameters

• Formula: C48 H34 Cl4 N2 O2 P2 Zn2
• Calculated formula: C48 H34 Cl4 N2 O2 P2 Zn2
• Title of publication: Playing with Pearson's concept: orthogonally functionalized 1,4-diaza-1,3-butadienes leading to heterobinuclear complexes.
• Authors of publication: Neu, J. P.; Di Martino-Fumo, P; Oelkers, B.; Sun, Y.; Neuba, A.; Gerhards, M.; Thiel, W. R.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 29
• Pages of publication: 9643 - 9656
• a: 13.8759 ± 0.0007 Å
• b: 14.0249 ± 0.0007 Å
• c: 22.7179 ± 0.0011 Å
• α: 88.254 ± 0.004°
• β: 78.344 ± 0.004°
• γ: 89.654 ± 0.004°
• Cell volume: 4327.9 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1069
• Residual factor for significantly intense reflections: 0.0798
• Weighted residual factors for significantly intense reflections: 0.2126
• Weighted residual factors for all reflections included in the refinement: 0.2298
• Goodness-of-fit parameter for all reflections included in the refinement: 1.102
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No