Information card for entry 7036502

Structure parameters

• Formula: C39 H37.5 Dy N7.5 O11 S2 Zn2
• Calculated formula: C39 H36 Dy N7.5 O11 S2 Zn2
• Title of publication: Structural switching from paramagnetic to single-molecule magnet behaviour of LnZn2 trinuclear complexes.
• Authors of publication: Then, Poh Ling; Takehara, Chika; Kataoka, Yumiko; Nakano, Motohiro; Yamamura, Tomoo; Kajiwara, Takashi
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 41
• Pages of publication: 18038 - 18048
• a: 10.92 ± 0.0011 Å
• b: 14.4384 ± 0.0015 Å
• c: 14.8871 ± 0.0015 Å
• α: 75.644 ± 0.004°
• β: 73.117 ± 0.004°
• γ: 73.178 ± 0.004°
• Cell volume: 2115.2 ± 0.4 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 7
• 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: 0.0319
• Weighted residual factors for significantly intense reflections: 0.0792
• Weighted residual factors for all reflections included in the refinement: 0.0809
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No