Information card for entry 4346584

Structure parameters

• Formula: C42 H36 Co N8 Na2
• Calculated formula: C42 H36 Co N8 Na2
• SMILES: c1cc2ccc[n]3c2[n]1([Na]13)[Co](n2ccc3ccc[n]1c23)([n]1([Na]23)ccc4ccc[n]2c14)[n]1ccc2ccc[n]3c12.c1(ccccc1)C.c1(ccccc1)C
• Title of publication: Homoleptic transition metal complexes of the 7-azaindolide ligand featuring κ(1)-N1 coordination.
• Authors of publication: Przyojski, Jacob A.; Kiewit, Monica L.; Fillman, Kathlyn L.; Arman, Hadi D.; Tonzetich, Zachary J.
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 19
• Pages of publication: 9637 - 9645
• a: 14.867 ± 0.004 Å
• b: 11.515 ± 0.003 Å
• c: 21.666 ± 0.007 Å
• α: 90°
• β: 98.757 ± 0.005°
• γ: 90°
• Cell volume: 3665.8 ± 1.8 ų
• Cell temperature: 98 ± 2 K
• Ambient diffraction temperature: 98 ± 2 K
• Number of distinct elements: 5
• 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: 0.0601
• Residual factor for significantly intense reflections: 0.05
• Weighted residual factors for significantly intense reflections: 0.1271
• Weighted residual factors for all reflections included in the refinement: 0.1357
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No