Information card for entry 7206458

Structure parameters

• Formula: C36 H42 N2 O2 Pd
• Calculated formula: C36 H42 N2 O2 Pd
• SMILES: [Pd]12(c3ccccc3c3[n]2cccc3)Oc2c(C=[N]1c1ccc(cc1)CCCCCC)ccc(OCCCCCC)c2
• Title of publication: Liaisons between photoconductivity and molecular frame in organometallic Pd(ii) and Pt(ii) complexes
• Authors of publication: Ghedini, Mauro; Golemme, Attilio; Aiello, Iolinda; Godbert, Nicolas; Termine, Roberto; Crispini, Alessandra; La Deda, Massimo; Lelj, Francesco; Amati, Mario; Belviso, Sandra
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2011
• Journal volume: 21
• Journal issue: 35
• Pages of publication: 13434
• a: 5.9863 ± 0.0004 Å
• b: 8.2081 ± 0.0007 Å
• c: 32.135 ± 0.003 Å
• α: 94.509 ± 0.004°
• β: 92.828 ± 0.004°
• γ: 92.317 ± 0.004°
• Cell volume: 1570.6 ± 0.2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0516
• Residual factor for significantly intense reflections: 0.0366
• Weighted residual factors for significantly intense reflections: 0.0848
• Weighted residual factors for all reflections included in the refinement: 0.1014
• Goodness-of-fit parameter for all reflections included in the refinement: 1.154
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No