Information card for entry 7038598

Structure parameters

• Common name: 1[ErCl3(dpa)(py)2]0.5(dpa)0.5(py)
• Chemical name: polycatena-[tri-chlorido-(μ-4-[1,2-bis(4-pyridyl) ethane]pyridine) -1κN1:1κN2-bis(pyridine)- erbium(III)]0.5([1,2-bis(4-pyridyl)ethane) 0.5(pyridine)
• Formula: C31 H31 Cl3 Er N5
• Calculated formula: C31 H31 Cl3 Er N5
• Title of publication: Luminescent coordination polymers for the VIS and NIR range constituting LnCl3 and 1,2-bis(4-pyridyl)ethane.
• Authors of publication: Dannenbauer, N.; Matthes, P. R.; Müller-Buschbaum, K
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 15
• Pages of publication: 6529 - 6540
• a: 9.3175 ± 0.001 Å
• b: 12.878 ± 0.0014 Å
• c: 13.971 ± 0.0016 Å
• α: 103.28 ± 0.002°
• β: 102.03 ± 0.003°
• γ: 101.88 ± 0.002°
• Cell volume: 1538 ± 0.3 ų
• Cell temperature: 168 ± 2 K
• Ambient diffraction temperature: 168 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0296
• Residual factor for significantly intense reflections: 0.0251
• Weighted residual factors for significantly intense reflections: 0.0538
• Weighted residual factors for all reflections included in the refinement: 0.0554
• Goodness-of-fit parameter for all reflections included in the refinement: 0.98
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No