Information card for entry 2009400

Structure parameters

• Chemical name: bis[4-(4-chlorophenyl)-1,2-dithia-3,5-diazolinium]chloride bis(maleonitriledithiolato)platinum
• Formula: C22 H8 Cl3 N8 Pt S8
• Calculated formula: C22 H8 Cl3 N8 Pt S8
• Title of publication: Structures of [PhCNSSN]~2~[Pt(mnt)~2~] and [(<i>p</i>-ClC~6~H~4~CNSSN)~2~Cl][Pt(mnt)~2~] (mnt = maleonitriledithiolato ligand)
• Authors of publication: Clegg, William; Birkby, Sara L.; Banister, Arthur J.; Rawson, Jeremy M.; Wait, Simon, T.; Rizkallah, Pierre; Harding, Marjorie M.; Blake, Alexander J.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1994
• Journal volume: 50
• Journal issue: 1
• Pages of publication: 28 - 33
• a: 13.545 ± 0.002 Å
• b: 33.147 ± 0.004 Å
• c: 13.756 ± 0.001 Å
• α: 90°
• β: 96.42 ± 0.01°
• γ: 90°
• Cell volume: 6137.4 ± 1.3 ų
• Cell temperature: 295 ± 1 K
• Ambient diffraction temperature: 295 ± 1 K
• Number of distinct elements: 6
• 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: 0.0818
• Residual factor for significantly intense reflections: 0.0608
• Weighted residual factors for all reflections: 0.1865
• Weighted residual factors for significantly intense reflections: 0.1594
• Goodness-of-fit parameter for all reflections: 1.068
• Goodness-of-fit parameter for significantly intense reflections: 1.094
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No