Information card for entry 7715500

Structure parameters

• Formula: C22 H36 B2 F8 Fe N18
• Calculated formula: C22 H36 B2 F8 Fe N18
• Title of publication: Expanding the dimensionality of bis(tetrazolyl)alkane-based Fe(II) coordination polymers by the application of dinitrile coligands.
• Authors of publication: Tołoczko, Aleksandra; Kaźmierczak, Marcin; Książek, Maria; Weselski, Marek; Siczek, Miłosz; Kusz, Joachim; Bronisz, Robert
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 16
• Pages of publication: 7163 - 7174
• a: 8.7981 ± 0.0015 Å
• b: 9.9945 ± 0.0019 Å
• c: 11.413 ± 0.002 Å
• α: 109.557 ± 0.018°
• β: 99.3 ± 0.016°
• γ: 112.58 ± 0.017°
• Cell volume: 823.2 ± 0.3 ų
• Cell temperature: 80 ± 1 K
• Ambient diffraction temperature: 80 ± 1 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0456
• Residual factor for significantly intense reflections: 0.0355
• Weighted residual factors for significantly intense reflections: 0.0862
• Weighted residual factors for all reflections included in the refinement: 0.0912
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No