Information card for entry 7014782

Structure parameters

• Common name: {[C,N]Pd(mu-OH)}2 (12)
• Formula: C53 H74 N6 O2 Pd2
• Calculated formula: C48 H62 N6 O2 Pd2
• SMILES: C12=[Pd]3(N(c4c(cccc4)N1C=CN2C(C)C)c1c(cccc1C(C)C)C(C)C)[OH][Pd]1(=C2N(C=CN2C(C)C)c2ccccc2N1c1c(cccc1C(C)C)C(C)C)[OH]3
• Title of publication: N-heterocyclic carbene tethered amido complexes of palladium and platinum.
• Authors of publication: Cross, Warren B.; Daly, Christopher G.; Ackerman, Rachel L.; George, Ian R.; Singh, Kuldip
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 2
• Pages of publication: 495 - 505
• a: 19.443 ± 0.002 Å
• b: 19.443 ± 0.002 Å
• c: 25.426 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 9612 ± 2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 88
• Hermann-Mauguin space group symbol: I 41/a :2
• Hall space group symbol: -I 4ad
• Residual factor for all reflections: 0.0497
• Residual factor for significantly intense reflections: 0.0378
• Weighted residual factors for significantly intense reflections: 0.0914
• Weighted residual factors for all reflections included in the refinement: 0.096
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No