Information card for entry 4342549

Structure parameters

• Formula: C32 H62 I2 N2 P4 Pt2
• Calculated formula: C32 H62 I2 N2 P4 Pt2
• SMILES: [Pt](I)([P](CC)(CC)CC)([P](CC)(CC)CC)C#Cc1nc(C#C[Pt](I)([P](CC)(CC)CC)[P](CC)(CC)CC)cnc1
• Title of publication: Pyrazine-based organometallic complex: synthesis, characterization, and supramolecular chemistry.
• Authors of publication: Bhowmick, Sourav; Chakraborty, Sourav; Das, Atanu; Rajamohanan, P. R.; Das, Neeladri
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 6
• Pages of publication: 2543 - 2550
• a: 40.263 ± 0.004 Å
• b: 9.4403 ± 0.0008 Å
• c: 23.128 ± 0.002 Å
• α: 90°
• β: 108.014 ± 0.003°
• γ: 90°
• Cell volume: 8359.9 ± 1.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.0436
• Residual factor for significantly intense reflections: 0.0344
• Weighted residual factors for significantly intense reflections: 0.0833
• Weighted residual factors for all reflections included in the refinement: 0.1031
• Goodness-of-fit parameter for all reflections included in the refinement: 1.157
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No