Information card for entry 4329003

Structure parameters

• Formula: K5 O61 Pd15 Se10
• Calculated formula: K5 O61 Pd15 Se10
• SMILES: [K+].O.[K+].[K+].[K+].O.[K+].O.O.[O]12[Pd]34O[Se]5=[O][Pd]67O[Se]8=[O][Pd]9%10O[Se]%11=[O][Pd]%12%13[O]%14[Pd](O[Se](=[O][Pd]%15%14O[Se]%14=[O][Pd]%162[O]%15[Pd]2(O%14)[O]%14[Pd]%15%17O[Se](=[O][Pd]%18%14[O]%14[Pd]1(O[Se](O%16)=[O]4)O[Se](O%18)=[O][Pd]1%14O[Se]4=[O][Pd]([O]69)(O8)[O]1[Pd]1([O]%15[Pd]([O]%10%13)([O]=[Se](O%17)O1)O%11)O4)O2)O%12)([O]37)O5.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O
• Title of publication: Cation-Induced Synthesis of New Polyoxopalladates
• Authors of publication: Zheng-Guo Lin; Bo Wang; Jie Cao; Bao-Kuan Chen; Yuan-Zhe Gao; Ying-Nan Chi; Chong Xu; Xian-Qiang Huang; Ruo-Dan Han; Shuang-Yue Su; Chang-Wen Hu
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 4435 - 4437
• a: 34.428 ± 0.002 Å
• b: 24.9433 ± 0.0017 Å
• c: 23.3876 ± 0.0016 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 20084 ± 2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 63
• Hermann-Mauguin space group symbol: C m c m
• Hall space group symbol: -C 2c 2
• Residual factor for all reflections: 0.1086
• Residual factor for significantly intense reflections: 0.0653
• Weighted residual factors for significantly intense reflections: 0.1922
• Weighted residual factors for all reflections included in the refinement: 0.2319
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No