Information card for entry 7704376

Structure parameters

• Formula: C33 H43 Co N2 O5
• Calculated formula: C33 H43 Co N2 O5
• SMILES: [Co]1([N](=CN(c2c(cccc2C(C)C)C(C)C)C1=O)c1c(cccc1C(C)C)C(C)C)(C#[O])(C#[O])C#[O].O1CCCC1
• Title of publication: 3d-4f heterometallic complexes by the reduction of transition metal carbonyls with bulky Ln^II amidinates.
• Authors of publication: Yadav, Ravi; Hossain, Md Elius; Peedika Paramban, Ramees; Simler, Thomas; Schoo, Christoph; Wang, Jun; Deacon, Glen B.; Junk, Peter C.; Roesky, Peter W.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 23
• Pages of publication: 7701 - 7707
• a: 11.1122 ± 0.001 Å
• b: 17.1592 ± 0.0017 Å
• c: 18.425 ± 0.002 Å
• α: 90°
• β: 100.195 ± 0.004°
• γ: 90°
• Cell volume: 3457.7 ± 0.6 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 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: 0.1341
• Residual factor for significantly intense reflections: 0.0675
• Weighted residual factors for significantly intense reflections: 0.1845
• Weighted residual factors for all reflections included in the refinement: 0.2308
• Goodness-of-fit parameter for all reflections included in the refinement: 0.944
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No