Information card for entry 4344968

Structure parameters

• Formula: C62 H60 Cl3 Co2 N24 O12
• Calculated formula: C62 H60 Cl3 Co2 N24 O12
• SMILES: N(=N#N)([Co]123[N](Cc4[n]2nn(c4)Cc2ccccc2)(Cc2[n]3nn(c2)Cc2ccccc2)Cc2[n]1nn(c2)Cc1ccccc1)[Co]123[n]4nn(Cc5ccccc5)cc4C[N]3(Cc3[n]2nn(c3)Cc2ccccc2)Cc2[n]1nn(c2)Cc1ccccc1.Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-].C(#N)C
• Title of publication: Control of Complex Formation through Peripheral Substituents in Click-Tripodal Ligands: Structural Diversity in Homo- and Heterodinuclear Cobalt-Azido Complexes.
• Authors of publication: Sommer, Michael G.; Marx, Raphael; Schweinfurth, David; Rechkemmer, Yvonne; Neugebauer, Petr; van der Meer, Margarethe; Hohloch, Stephan; Demeshko, Serhiy; Meyer, Franc; van Slageren, Joris; Sarkar, Biprajit
• Journal of publication: Inorganic chemistry
• Year of publication: 2017
• Journal volume: 56
• Journal issue: 1
• Pages of publication: 402 - 413
• a: 17.022 ± 0.003 Å
• b: 15.856 ± 0.003 Å
• c: 27.632 ± 0.006 Å
• α: 90°
• β: 102.54 ± 0.03°
• γ: 90°
• Cell volume: 7280 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.1254
• Residual factor for significantly intense reflections: 0.079
• Weighted residual factors for significantly intense reflections: 0.2081
• Weighted residual factors for all reflections included in the refinement: 0.2371
• Goodness-of-fit parameter for all reflections included in the refinement: 0.982
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No