Information card for entry 7023648

Structure parameters

• Formula: C27 H25 Cl N O P Pd
• Calculated formula: C27 H25 Cl N O P Pd
• SMILES: [Pd]1(c2c(C=[N]1CCO)cccc2)(Cl)[P](c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Metal array fabrication based on ultrasound-induced self-assembly of metalated dipeptides.
• Authors of publication: Isozaki, Katsuhiro; Haga, Yusuke; Ogata, Kazuki; Naota, Takeshi; Takaya, Hikaru
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 45
• Pages of publication: 15953 - 15966
• a: 18.121 ± 0.009 Å
• b: 9.62 ± 0.005 Å
• c: 27.973 ± 0.015 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4876 ± 4 ų
• Cell temperature: 223.1 K
• Ambient diffraction temperature: 223.1 K
• Number of distinct elements: 7
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for significantly intense reflections: 0.0606
• Weighted residual factors for all reflections included in the refinement: 0.1503
• Goodness-of-fit parameter for all reflections included in the refinement: 1.001
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No