Information card for entry 4081842

Structure parameters

• Formula: C20 H25 Cl4 N2 Rh
• Calculated formula: C20 H25 Cl4 N2 Rh
• SMILES: c12ccccc1C1=[N](CCN1)[Rh]13452([c]2([c]1([c]3([c]4([c]52C)C)C)C)C)Cl.C(Cl)(Cl)Cl
• Title of publication: Serendipitous Self-Assembly of Cyclometalated Complexes through Hydrogen Bonds: Dimers or Chains within Compact or Porous Networks
• Authors of publication: Barloy, Laurent; Féghali, Elias; Henry, Marc; Karmazin-Brelot, Lydia; Bailly, Corinne; Pfeffer, Michel
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 21
• Pages of publication: 6195
• a: 15.0485 ± 0.0005 Å
• b: 12.6827 ± 0.0005 Å
• c: 11.7123 ± 0.0003 Å
• α: 90°
• β: 101.188 ± 0.002°
• γ: 90°
• Cell volume: 2192.88 ± 0.13 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• 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: 0.0536
• Residual factor for significantly intense reflections: 0.0369
• Weighted residual factors for significantly intense reflections: 0.1001
• Weighted residual factors for all reflections included in the refinement: 0.1191
• Goodness-of-fit parameter for all reflections included in the refinement: 1.12
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No