Information card for entry 4331648

Structure parameters

• Formula: C19 H13 Co O2 Se4 W
• Calculated formula: C19 H13 Co O2 Se4 W
• SMILES: c12ccccc1[Se][W]13(C#[O])(C#[O])([Co]45678([cH]9[cH]4[cH]5[cH]6[cH]79)[Se]1c1ccccc1[Se]38)[Se]2
• Title of publication: Synthesis of Heterometal Cluster Complexes by the Reaction of Cobaltadichalcogenolato Complexes with Groups 6 and 8 Metal Carbonyls
• Authors of publication: Murata, Masaki; Habe, Satoru; Araki, Shingo; Namiki, Kosuke; Yamada, Teppei; Nakagawa, Norikiyo; Nankawa, Takuya; Nihei, Masayuki; Mizutani, Jun; Kurihara, Masato; Nishihara, Hiroshi
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 3
• Pages of publication: 1108 - 1116
• a: 8.079 ± 0.005 Å
• b: 10.432 ± 0.006 Å
• c: 13.196 ± 0.008 Å
• α: 66.93 ± 0.02°
• β: 81.35 ± 0.03°
• γ: 77.75 ± 0.03°
• Cell volume: 997.1 ± 1.1 ų
• Cell temperature: 120 ± 5 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 significantly intense reflections: 0.0911
• Weighted residual factors for all reflections included in the refinement: 0.2451
• Goodness-of-fit parameter for all reflections included in the refinement: 1.124
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No