Information card for entry 7250620

Structure parameters

• Formula: C14 H14 Br2 N4 O6 Sr
• Calculated formula: C14 H14 Br2 N4 O6 Sr
• Title of publication: Impact of ligand functionalization on the structure of strontium MOFs prepared in a deep eutectic solvent
• Authors of publication: Teixeira, Michaël; Baudron, Stéphane A.
• Journal of publication: CrystEngComm
• Year of publication: 2025
• Journal volume: 27
• Journal issue: 32
• Pages of publication: 5421 - 5430
• a: 8.3624 ± 0.0003 Å
• b: 10.0318 ± 0.0004 Å
• c: 11.0092 ± 0.0004 Å
• α: 93.106 ± 0.001°
• β: 90.183 ± 0.001°
• γ: 100.056 ± 0.001°
• Cell volume: 907.96 ± 0.06 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.034
• Residual factor for significantly intense reflections: 0.0248
• Weighted residual factors for significantly intense reflections: 0.0539
• Weighted residual factors for all reflections included in the refinement: 0.0575
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No