Information card for entry 4514587

Structure parameters

• Formula: C11 H10 Fe O2
• Calculated formula: C11 H10 Fe O2
• SMILES: [cH]12[cH]3[cH]4[cH]5[cH]1[Fe]16782345[cH]2[cH]1[cH]6[cH]7[c]82C(=O)O
• Title of publication: Ultrahigh Proton Conduction in Two Highly Stable Ferrocenyl Carboxylate Frameworks.
• Authors of publication: Qin, Yin; Gao, Tian-Li; Xie, Wen-Ping; Li, Zifeng; Li, Gang
• Journal of publication: ACS applied materials & interfaces
• Year of publication: 2019
• Journal volume: 11
• Journal issue: 34
• Pages of publication: 31018 - 31027
• a: 5.809 ± 0.0002 Å
• b: 12.8698 ± 0.0005 Å
• c: 12.5766 ± 0.0004 Å
• α: 90°
• β: 97.114 ± 0.003°
• γ: 90°
• Cell volume: 933 ± 0.06 ų
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.048
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No