Information card for entry 1513253

Structure parameters

• Chemical name: tetrakis((μ~3~-iodo)-piperidine copper(I))
• Formula: C20 H44 Cu4 I4 N4
• Calculated formula: C20 H44 Cu4 I4 N4
• SMILES: [I]12[Cu]3456([I]7[Cu]8914([I]1[Cu]4578([I]3[Cu]26914[NH]1CCCCC1)[NH]1CCCCC1)[NH]1CCCCC1)[NH]1CCCCC1
• Title of publication: Optimizing the accuracy and precision of the single-pulse Laue technique for synchrotron photo-crystallography
• Authors of publication: Kamiński, Radosław; Graber, Timothy; Benedict, Jason B.; Henning, Robert; Chen, Yu-Sheng; Scheins, Stephan; Messerschmidt, Marc; Coppens, Philip
• Journal of publication: Journal of Synchrotron Radiation
• Year of publication: 2010
• Journal volume: 17
• Journal issue: 4
• Pages of publication: 479 - 485
• a: 14.6049 ± 0.0012 Å
• b: 14.6049 ± 0.0012 Å
• c: 7.5464 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1609.7 ± 0.3 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 5
• Space group number: 86
• Hermann-Mauguin space group symbol: P 42/n :2
• Hall space group symbol: -P 4bc
• Residual factor for all reflections: 0.031
• Residual factor for significantly intense reflections: 0.0239
• Weighted residual factors for significantly intense reflections: 0.0549
• Weighted residual factors for all reflections included in the refinement: 0.0602
• Goodness-of-fit parameter for all reflections included in the refinement: 1.106
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No