Information card for entry 7701590

Structure parameters

• Formula: C59 H61 Br2 Cl9 N8 O2 Pd2
• Calculated formula: C59 H61 Br2 Cl9 N8 O2 Pd2
• Title of publication: Classifying donor strengths of dipyrrinato/aza-dipyrrinato ligands.
• Authors of publication: Diaz-Rodriguez, Roberto M; Robertson, Katherine N.; Thompson, Alison
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 22
• Pages of publication: 7546 - 7550
• a: 15.098 ± 0.003 Å
• b: 9.615 ± 0.0018 Å
• c: 23.539 ± 0.004 Å
• α: 90°
• β: 108.426 ± 0.002°
• γ: 90°
• Cell volume: 3241.9 ± 1 ų
• Cell temperature: 125 ± 2 K
• Ambient diffraction temperature: 125 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0479
• Residual factor for significantly intense reflections: 0.0314
• Weighted residual factors for significantly intense reflections: 0.0667
• Weighted residual factors for all reflections included in the refinement: 0.0728
• 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: Yes
• Has Fobs: No