Information card for entry 7006044

Structure parameters

• Common name: (H2B(3-NO2Pz)2)AgPTol3
• Formula: C27 H27 Ag B N6 O4 P
• Calculated formula: C27 H27 Ag B N6 O4 P
• SMILES: [Ag]1([P](c2ccc(cc2)C)(c2ccc(cc2)C)c2ccc(cc2)C)[n]2n([BH2]n3[n]1c(N(=O)=O)cc3)ccc2N(=O)=O
• Title of publication: Silver(I)-organophosphane complexes of electron withdrawing CF3- or NO2-substituted scorpionate ligands.
• Authors of publication: Pellei, Maura; Alidori, Simone; Papini, Grazia; Lobbia, Giancarlo Gioia; Gorden, John D.; Dias, H. V. Rasika; Santini, Carlo
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 42
• Pages of publication: 4845 - 4853
• a: 35.4543 ± 0.0015 Å
• b: 10.6701 ± 0.0005 Å
• c: 15.0076 ± 0.0006 Å
• α: 90°
• β: 94.616 ± 0.001°
• γ: 90°
• Cell volume: 5659 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0268
• Residual factor for significantly intense reflections: 0.0252
• Weighted residual factors for significantly intense reflections: 0.0664
• Weighted residual factors for all reflections included in the refinement: 0.0677
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No