Information card for entry 4106777

Structure parameters

• Formula: C4 H Fe O3.92
• Calculated formula: C4 H Fe O3.92
• Title of publication: Selective Binding of O2 over N2 in a Redox-Active Metal-Organic Framework with Open Iron(II) Coordination Sites
• Authors of publication: Eric D. Bloch; Leslie J. Murray; Wendy L. Queen; Sachin Chavan; Sergey N. Maximoff; Julian P. Bigi; Rajamani Krishna; Vanessa K. Peterson; Fernande Grandjean; Gary J. Long; Berend Smit; Silvia Bordiga; Craig M. Brown; Jeffrey R. Long
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2011
• Journal volume: 133
• Pages of publication: 14814 - 14822
• a: 26.0087 ± 0.0013 Å
• b: 26.0087 Å
• c: 6.8131 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 3991.3 ± 0.5 ų
• Number of distinct elements: 4
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Goodness-of-fit parameter for all reflections: 1.01
• Method of determination: powder diffraction
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No