Information card for entry 7235722

Structure parameters

• Formula: C5 H9 Cl7 N Nb O
• Calculated formula: C5 H9 Cl7 N Nb O
• Title of publication: A simple route to thermally-stable salts of pyrrolidinium-2-carbonylchloride
• Authors of publication: Marchetti, Fabio; Pampaloni, Guido; Zacchini, Stefano
• Journal of publication: RSC Adv.
• Year of publication: 2014
• Journal volume: 4
• Journal issue: 105
• Pages of publication: 60878
• a: 6.658 ± 0.002 Å
• b: 13.408 ± 0.004 Å
• c: 15.881 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1417.7 ± 0.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0259
• Residual factor for significantly intense reflections: 0.0238
• Weighted residual factors for significantly intense reflections: 0.0492
• Weighted residual factors for all reflections included in the refinement: 0.0502
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No