Information card for entry 4514596

Structure parameters

• Formula: C27 H25 Gd N4 O8
• Calculated formula: C27 H25 Gd N4 O8
• Title of publication: Three-Photon Absorption of Coordination Polymer Transforms UV-to-VIS Thermometry into NIR-to-VIS Thermometry.
• Authors of publication: Zaręba, Jan K; Nyk, Marcin; Janczak, Jan; Samoć, Marek
• Journal of publication: ACS applied materials & interfaces
• Year of publication: 2019
• Journal volume: 11
• Journal issue: 11
• Pages of publication: 10435 - 10441
• a: 16.5673 ± 0.0002 Å
• b: 15.2797 ± 0.0002 Å
• c: 21.0925 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5339.43 ± 0.12 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0549
• Residual factor for significantly intense reflections: 0.0295
• Weighted residual factors for significantly intense reflections: 0.0617
• Weighted residual factors for all reflections included in the refinement: 0.0734
• Goodness-of-fit parameter for all reflections included in the refinement: 1.002
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No