Information card for entry 7027570

Structure parameters

• Chemical name: cis-bis-(3,3,3',3'-tetraethyl-1,1'-isophthaloyl-bis(thiourea))platinum(II)
• Formula: C18 H24 N4 O2 Pt S2
• Calculated formula: C18 H24 N4 O2 Pt S2
• Title of publication: Self-assembly of 2∶2 and 3∶3 metallamacrocyclic complexes of platinum(II) with symmetrical, bipodal N′,N′,N ‴N ‴-tetraalkyl-N,N ″-phenylenedicarbonylbis(thiourea)
• Authors of publication: Koch, Klaus R.; Bourne, Susan A.; Coetzee, Anita; Miller, Jörn
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1999
• Journal issue: 18
• Pages of publication: 3157
• a: 8.3986 ± 0.0002 Å
• b: 9.7283 ± 0.0003 Å
• c: 13.0248 ± 0.0004 Å
• α: 80.512 ± 0.002°
• β: 82.187 ± 0.003°
• γ: 84.719 ± 0.002°
• Cell volume: 1037.23 ± 0.05 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0222
• Residual factor for significantly intense reflections: 0.0197
• Weighted residual factors for significantly intense reflections: 0.0494
• Weighted residual factors for all reflections included in the refinement: 0.0512
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No