Information card for entry 4347798

Structure parameters

• Formula: C46 H44 N4 Pt S3
• Calculated formula: C46 H44 N4 Pt S3
• Title of publication: Synthesis and Photochromic Studies of Dithienylethene-Containing Cyclometalated Alkynylplatinum(II) 1,3-Bis(N-alkylbenzimidazol-2'-yl)benzene Complexes.
• Authors of publication: Chan, Michael Ho-Yeung; Wong, Hok-Lai; Yam, Vivian Wing-Wah
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 11
• Pages of publication: 5570 - 5577
• a: 13.31 ± 0.003 Å
• b: 17.748 ± 0.004 Å
• c: 19.448 ± 0.004 Å
• α: 70.576 ± 0.003°
• β: 78.466 ± 0.003°
• γ: 77.561 ± 0.003°
• Cell volume: 4189.7 ± 1.6 ų
• Cell temperature: 301 ± 2 K
• Ambient diffraction temperature: 301 ± 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: 0.057
• Residual factor for significantly intense reflections: 0.0338
• Weighted residual factors for significantly intense reflections: 0.0751
• Weighted residual factors for all reflections included in the refinement: 0.0831
• Goodness-of-fit parameter for all reflections included in the refinement: 0.978
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No