Information card for entry 4345627

Structure parameters

• Formula: C85 H154 Er5 N4 O48 P6
• Calculated formula: C85 H154 Er5 N4 O48 P6
• Title of publication: Pentanuclear Lanthanide Mono-organophosphates: Synthesis, Structure, and Magnetism.
• Authors of publication: Gupta, Sandeep K.; Langley, Stuart K.; Sharma, Kamna; Murray, Keith S.; Murugavel, Ramaswamy
• Journal of publication: Inorganic chemistry
• Year of publication: 2017
• Journal volume: 56
• Journal issue: 7
• Pages of publication: 3946 - 3960
• a: 15.253 ± 0.003 Å
• b: 16.025 ± 0.003 Å
• c: 26.013 ± 0.005 Å
• α: 93.779 ± 0.003°
• β: 99.26 ± 0.002°
• γ: 106.619 ± 0.002°
• Cell volume: 5971 ± 2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 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 all reflections: 0.0404
• Residual factor for significantly intense reflections: 0.0384
• Weighted residual factors for significantly intense reflections: 0.0911
• Weighted residual factors for all reflections included in the refinement: 0.0929
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No