Information card for entry 7102574

Structure parameters

• Formula: C80 H44 Co6 O14 P4
• Calculated formula: C80 H44 Co6 O14 P4
• SMILES: C1[P]([Co]23(C4(C#CC#CC#CC#CC#CC#CC#CC56[Co]78([P](C[P]([Co]57(C#[O])(C#[O])[Co]68(C#[O])(C#[O])C#[O])(c5ccccc5)c5ccccc5)(c5ccccc5)c5ccccc5)(C#[O])C#[O])[Co]2([P]1(c1ccccc1)c1ccccc1)(C#[O])(C#[O])[Co]34(C#[O])(C#[O])C#[O])(C#[O])C#[O])(c1ccccc1)c1ccccc1
• Title of publication: A novel methodology for the synthesis of complexes containing long carbon chains linking metal centres: molecular structures of [Ru(dppe)Cp*]2(mu-C14) and [Co3(mu-dppm)(CO)7]2(mu3:mu3-C16).
• Authors of publication: Antonova, Alla B; Bruce, Michael I; Ellis, Benjamin G; Gaudio, Maryka; Humphrey, Paul A; Jevric, Martyn; Melino, Giovanni; Nicholson, Brian K; Perkins, Gary J; Skelton, Brian W; Stapleton, Bronwin; White, Allan H; Zaitseva, Natasha N
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2004
• Journal issue: 8
• Pages of publication: 960 - 961
• a: 9.17 ± 0.001 Å
• b: 19.914 ± 0.003 Å
• c: 20.221 ± 0.003 Å
• α: 90°
• β: 97.901 ± 0.003°
• γ: 90°
• Cell volume: 3657.5 ± 0.9 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.095
• Residual factor for significantly intense reflections: 0.057
• Weighted residual factors for all reflections: 0.078
• Weighted residual factors for all reflections included in the refinement: 0.067
• Goodness-of-fit parameter for all reflections: 1.042
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No