Information card for entry 7003638

Structure parameters

• Formula: C39 H32 Cl N4 P Pt
• Calculated formula: C39 H32 Cl N4 P Pt
• SMILES: [Pd]12(c3ccccc3c3[n]1c(ccc3)c1ccccc1)[P](c1ccccc1)(c1ccccc1)CNc1[n]2c2nc(ccc2cc1)C.[Cl-]
• Title of publication: Synthesis, structures and photophysical properties of luminescent copper(i) and platinum(ii) complexes with a flexible naphthyridine-phosphine ligand
• Authors of publication: Zhang, Jun-Feng; Fu, Wen-Fu; Gan, Xin; Chen, Jian-Hua
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 23
• Pages of publication: 3093 - 3100
• a: 37.565 ± 0.008 Å
• b: 10.6978 ± 0.0019 Å
• c: 22.217 ± 0.005 Å
• α: 90°
• β: 132.471 ± 0.002°
• γ: 90°
• Cell volume: 6586 ± 2 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 2 K
• Number of distinct elements: 6
• 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: 0.0351
• Residual factor for significantly intense reflections: 0.0288
• Weighted residual factors for significantly intense reflections: 0.0659
• Weighted residual factors for all reflections included in the refinement: 0.0687
• Goodness-of-fit parameter for all reflections included in the refinement: 1.078
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No