Information card for entry 4079164

Structure parameters

• Formula: C20 H20 Br2 N4 Pt
• Calculated formula: C20 H20 Br2 N4 Pt
• SMILES: [Pt]1(Br)(Br)([n]2ccccc2C=[N]1c1ccc(N=Nc2ccccc2)cc1)(C)C
• Title of publication: Switching by Photochemicaltrans‒cisIsomerization of Azobenzene Substituents in Organoplatinum Complexes
• Authors of publication: Moustafa, Mohamed E.; McCready, Matthew S.; Puddephatt, Richard J.
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 17
• Pages of publication: 6262
• a: 16.7538 ± 0.0004 Å
• b: 8.615 ± 0.0002 Å
• c: 17.6515 ± 0.0004 Å
• α: 90°
• β: 110.52 ± 0.001°
• γ: 90°
• Cell volume: 2386.06 ± 0.1 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0347
• Residual factor for significantly intense reflections: 0.0245
• Weighted residual factors for significantly intense reflections: 0.0555
• Weighted residual factors for all reflections included in the refinement: 0.0583
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No