Information card for entry 4074263

Structure parameters

• Formula: C34 H36 N4 O3 Pt
• Calculated formula: C34 H34 N4 O3 Pt
• SMILES: O.[Pt]12(=C3N(c4ccccc4N3CCCC)c3c(O1)cccc3)Oc1c(N3C=2N(c2c3cccc2)CCCC)cccc1
• Title of publication: Synthesis and Study of Bidentate Benzimidazolylidene−Group 10 Metal Complexes and Related Main-Chain Organometallic Polymers
• Authors of publication: Boydston, Andrew J.; Rice, Jonathan D.; Sanderson, Matthew D.; Dykhno, Olga L.; Bielawski, Christopher W.
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 26
• Pages of publication: 6087
• a: 12.521 ± 0.0005 Å
• b: 13.87 ± 0.0006 Å
• c: 18.694 ± 0.001 Å
• α: 90.248 ± 0.002°
• β: 102.67 ± 0.002°
• γ: 99.004 ± 0.0017°
• Cell volume: 3125.9 ± 0.3 ų
• Cell temperature: 233 ± 2 K
• Ambient diffraction temperature: 233 ± 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: 0.1179
• Residual factor for significantly intense reflections: 0.0654
• Weighted residual factors for significantly intense reflections: 0.1355
• Weighted residual factors for all reflections included in the refinement: 0.1664
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No