Information card for entry 2227047

Structure parameters

• Chemical name: Tetraethylammonium tricarbonylchlorido(quinoxaline-2- carboxylato-κ^2^<i>N</i>^1^,<i>O</i>)rhenate(I)
• Formula: C20 H25 Cl N3 O5 Re
• Calculated formula: C20 H25 Cl N3 O5 Re
• SMILES: [Re]1(Cl)(C#[O])(OC(=O)c2[n]1c1ccccc1nc2)(C#[O])C#[O].[N+](CC)(CC)(CC)CC
• Title of publication: Tetraethylammonium tricarbonylchlorido(quinoxaline-2-carboxylato-κ^2^<i>N</i>^1^,<i>O</i>)rhenate(I)
• Authors of publication: Suthiram, Janine; Zeevaart, Jan Rijn; Visser, Hendrik G.; Roodt, Andreas
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 8
• Pages of publication: m1042 - m1043
• a: 8.402 ± 0.005 Å
• b: 10.077 ± 0.005 Å
• c: 13.495 ± 0.005 Å
• α: 97.433 ± 0.005°
• β: 103.141 ± 0.005°
• γ: 90.686 ± 0.005°
• Cell volume: 1102.3 ± 0.9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.0273
• Weighted residual factors for all reflections included in the refinement: 0.0654
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes