Information card for entry 7019284

Structure parameters

• Formula: C44 H42 Cr2 Fe N18 O
• Calculated formula: C44 H42 Cr2 Fe N18 O
• Title of publication: Synthesis, characterization and thermal properties of trimetallic N(3)-Cr[quadruple bond, length as m-dash]CrM-N(3) azide complexes with M = Cr, Mn, Fe, and Co.
• Authors of publication: Turov, Yevgeniya; Berry, John F.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 26
• Pages of publication: 8153 - 8161
• a: 15.945 ± 0.0005 Å
• b: 16.2777 ± 0.0005 Å
• c: 17.643 ± 0.0006 Å
• α: 90°
• β: 104.433 ± 0.002°
• γ: 90°
• Cell volume: 4434.7 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0496
• Residual factor for significantly intense reflections: 0.0403
• Weighted residual factors for significantly intense reflections: 0.1443
• Weighted residual factors for all reflections included in the refinement: 0.1513
• Goodness-of-fit parameter for all reflections included in the refinement: 1.126
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No