Information card for entry 4338256

Structure parameters

• Common name: [CoN4]
• Formula: C15 H21 Co N4
• Calculated formula: C15 H21 Co N4
• SMILES: [Co]123N4CCC[N]3=C(c3[n]1c(C(=[N]2CCC4)C)ccc3)C
• Title of publication: Studies of Cobalt-Mediated Electrocatalytic CO2 Reduction Using a Redox-Active Ligand.
• Authors of publication: Lacy, David C.; McCrory, Charles C. L.; Peters, Jonas C.
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 10
• Pages of publication: 4980 - 4988
• a: 19.365 ± 0.003 Å
• b: 5.0144 ± 0.0007 Å
• c: 15.594 ± 0.002 Å
• α: 90°
• β: 111.445 ± 0.003°
• γ: 90°
• Cell volume: 1409.4 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• 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: 0.0476
• Residual factor for significantly intense reflections: 0.0339
• Weighted residual factors for significantly intense reflections: 0.0812
• Weighted residual factors for all reflections included in the refinement: 0.085
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No