Information card for entry 7720015

Structure parameters

• Formula: C14 H22 Fe Li2 N18 O8
• Calculated formula: C14 H22 Fe Li2 N18 O8
• Title of publication: Locking the spin states of anionic Fe(L)₂ units in coordination polymers through alkali metal ion incorporation.
• Authors of publication: Zhou, Jing-Yao; Zhang, Hong-Dong; Yin, Fan; Zhu, Zheng-Zhong; Zhou, Li-Peng; Tian, Chong-Bin; Sun, Qing-Fu
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2026
• Journal volume: 55
• Journal issue: 10
• Pages of publication: 4319 - 4326
• a: 13.983 ± 0.0005 Å
• b: 21.1145 ± 0.0011 Å
• c: 8.9586 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2645 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 68
• Hermann-Mauguin space group symbol: C c c a :2
• Hall space group symbol: -C 2a 2ac
• Residual factor for all reflections: 0.0392
• Residual factor for significantly intense reflections: 0.0364
• Weighted residual factors for significantly intense reflections: 0.0976
• Weighted residual factors for all reflections included in the refinement: 0.0991
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No