Information card for entry 7129072

Structure parameters

• Formula: C25 H31 F4 Gd I2 N2 O3
• Calculated formula: C25 H31 F4 Gd I2 N2 O3
• SMILES: [Gd]1(I)(I)([O]2CCCC2)([O]2CCCC2)([O]2CCCC2)N(C=[N]1c1c(F)cccc1F)c1c(F)cccc1F
• Title of publication: A simple one-pot route to stable formamidinatoiodidolanthanoid(III) complexes from lanthanoid metals.
• Authors of publication: Guo, Zhifang; Blair, Victoria L.; Deacon, Glen B.; Junk, Peter C.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2021
• Journal volume: 57
• Journal issue: 87
• Pages of publication: 11513 - 11516
• a: 12.811 ± 0.003 Å
• b: 9.475 ± 0.0019 Å
• c: 23.728 ± 0.005 Å
• α: 90°
• β: 91.79 ± 0.03°
• γ: 90°
• Cell volume: 2878.8 ± 1.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0358
• Residual factor for significantly intense reflections: 0.0335
• Weighted residual factors for significantly intense reflections: 0.0791
• Weighted residual factors for all reflections included in the refinement: 0.0797
• Goodness-of-fit parameter for all reflections included in the refinement: 1.183
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No