Information card for entry 7202057

Structure parameters

• Formula: C22 H32 N8 O10 Pt S4
• Calculated formula: C22 H32 N8 O10 Pt S4
• SMILES: C1(NC=CN1C)=[S][Pt]([S]=C1NC=CN1C)([S]=C1NC=CN1C)[S]=C1NC=CN1C.C1([O-])=C([O-])C(=O)C(=O)C(=O)C1=O.O.O.O.O
• Title of publication: Hydrogen bonded networks in N‒alkyl substituted thiourea platinum (II) oxocarbodianion and carboxylate salts
• Authors of publication: Fisher, Matthew G.; Gale, Philip A.; Light, Mark E.; Quesada, Roberto
• Journal of publication: CrystEngComm
• Year of publication: 2008
• Journal volume: 10
• Journal issue: 9
• Pages of publication: 1180
• a: 8.933 ± 0.0002 Å
• b: 9.1168 ± 0.0002 Å
• c: 10.3243 ± 0.0003 Å
• α: 73.117 ± 0.001°
• β: 89.962 ± 0.001°
• γ: 74.79 ± 0.001°
• Cell volume: 773.79 ± 0.03 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.0197
• Residual factor for significantly intense reflections: 0.0196
• Weighted residual factors for significantly intense reflections: 0.0413
• Weighted residual factors for all reflections included in the refinement: 0.0414
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No