Information card for entry 1568868

Structure parameters

• Formula: C42 H50 N4 Pt
• Calculated formula: C42 H50 N4 Pt
• Title of publication: Efficient blue-phosphorescent <i>trans</i>-bis(acyclic diaminocarbene) platinum(ii) acetylide complexes.
• Authors of publication: Nguyen, Yennie H.; Dang, Vinh Q.; Soares, João Vitor; Wu, Judy I.; Teets, Thomas S.
• Journal of publication: Chemical science
• Year of publication: 2023
• Journal volume: 14
• Journal issue: 18
• Pages of publication: 4857 - 4862
• a: 9.974 ± 0.005 Å
• b: 13.582 ± 0.006 Å
• c: 14.781 ± 0.007 Å
• α: 94.4 ± 0.006°
• β: 104.251 ± 0.005°
• γ: 106.946 ± 0.005°
• Cell volume: 1832.5 ± 1.5 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0284
• Residual factor for significantly intense reflections: 0.0256
• Weighted residual factors for significantly intense reflections: 0.0686
• Weighted residual factors for all reflections included in the refinement: 0.0696
• Goodness-of-fit parameter for all reflections included in the refinement: 1.136
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No