Information card for entry 7007627

Structure parameters

• Formula: C24 H48 Cr N7
• Calculated formula: C24 H48 Cr N7
• SMILES: c1(C)n2[Cr]34([N](=C(C)N3C(C)(C)C)C(C)(C)C)([n]2c(n1)C)[N](=C(C)N4C(C)(C)C)C(C)(C)C
• Title of publication: Synthesis, structural characterization, and properties of chromium(III) complexes containing amidinato ligands and eta2-pyrazolato, eta(2)-1,2,4-triazolato, or eta1-tetrazolato ligands.
• Authors of publication: El-Kadri, Oussama M; Heeg, Mary Jane; Winter, Charles H.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 37
• Pages of publication: 4506 - 4513
• a: 11.4119 ± 0.0011 Å
• b: 16.3633 ± 0.0016 Å
• c: 15.2947 ± 0.0015 Å
• α: 90°
• β: 96.556 ± 0.002°
• γ: 90°
• Cell volume: 2837.4 ± 0.5 ų
• Cell temperature: 213 ± 2 K
• Ambient diffraction temperature: 213 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0347
• Residual factor for significantly intense reflections: 0.0313
• Weighted residual factors for significantly intense reflections: 0.0932
• Weighted residual factors for all reflections included in the refinement: 0.0957
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No