Information card for entry 7202055

Structure parameters

• Formula: C12 H24 N8 O4 Pt S4
• Calculated formula: C12 H24 N8 O4 Pt S4
• SMILES: CNC(N)=[S][Pt]([S]=C(N)NC)([S]=C(N)NC)[S]=C(N)NC.C1([O-])=C([O-])C(=O)C1=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: 9.9248 ± 0.0002 Å
• b: 11.2125 ± 0.0003 Å
• c: 11.4504 ± 0.0003 Å
• α: 62.074 ± 0.001°
• β: 86.405 ± 0.001°
• γ: 87.683 ± 0.001°
• Cell volume: 1123.54 ± 0.05 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: 0.019
• Residual factor for significantly intense reflections: 0.018
• Weighted residual factors for significantly intense reflections: 0.0425
• Weighted residual factors for all reflections included in the refinement: 0.0429
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No