Information card for entry 4349592

Structure parameters

• Formula: C13 H11 N7 O Pb
• Calculated formula: C13 H11 N7 O Pb
• SMILES: [Pb]12(OC(=N[N]1=C(C)c1[n]2cccc1)c1cnccc1)N=N#N
• Title of publication: Anion-driven tetrel bond-induced engineering of lead(ii) architectures with N′-(1-(2-pyridyl)ethylidene)nicotinohydrazide: experimental and theoretical findings
• Authors of publication: Mahmoudi, Ghodrat; Safin, Damir A.; Mitoraj, Mariusz P.; Amini, Mojtaba; Kubicki, Maciej; Doert, Thomas; Locherer, Franziska; Fleck, Michel
• Journal of publication: Inorganic Chemistry Frontiers
• Year of publication: 2017
• Journal volume: 4
• Journal issue: 1
• Pages of publication: 171
• a: 7.4765 ± 0.0003 Å
• b: 9.8748 ± 0.0005 Å
• c: 10.3866 ± 0.0009 Å
• α: 85.982 ± 0.006°
• β: 77.23 ± 0.007°
• γ: 71.633 ± 0.006°
• Cell volume: 709.77 ± 0.08 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0263
• Residual factor for significantly intense reflections: 0.0239
• Weighted residual factors for significantly intense reflections: 0.0611
• Weighted residual factors for all reflections included in the refinement: 0.0619
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No