Information card for entry 7031706

Structure parameters

• Formula: C24 H36 B2 F8 Fe0.31 N18 Zn0.69
• Calculated formula: C24 H36 B2 F8 Fe0.31 N18 Zn0.6901
• Title of publication: Light-induced spin-state switching in the mixed crystal series of the 2D coordination network {[Zn1-xFex(bbtr)3](BF4)2}∞: optical spectroscopy and cooperative effects.
• Authors of publication: Chakraborty, Pradip; Enachescu, Cristian; Humair, Arnaud; Egger, Leo; Delgado, Teresa; Tissot, Antoine; Guénée, Laure; Besnard, Céline; Bronisz, Robert; Hauser, Andreas
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 47
• Pages of publication: 17786 - 17796
• a: 11.5915 ± 0.0003 Å
• b: 11.5915 ± 0.0003 Å
• c: 7.5372 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 877.04 ± 0.04 ų
• Cell temperature: 10 ± 2 K
• Ambient diffraction temperature: 10 K
• Number of distinct elements: 7
• Space group number: 147
• Hermann-Mauguin space group symbol: P -3
• Hall space group symbol: -P 3
• Residual factor for all reflections: 0.042
• Residual factor for significantly intense reflections: 0.041
• Weighted residual factors for significantly intense reflections: 0.1162
• Weighted residual factors for all reflections included in the refinement: 0.1186
• Goodness-of-fit parameter for all reflections included in the refinement: 1.112
• Diffraction radiation wavelength: 0.69412 Å
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No