Information card for entry 2310151

Structure parameters

• Formula: C411.01 H417.06 Cl1.65 I47.98 N96 O20.41 Zn23.99
• Calculated formula: C410.998 H417.038 Cl1.65 I47.954 N96 O20.408 Zn23.977
• Title of publication: Analysis of rapidly synthesized guest-filled porous complexes with synchrotron radiation: practical guidelines for the crystalline sponge method
• Authors of publication: Ramadhar, Timothy R.; Zheng, Shao-Liang; Chen, Yu-Sheng; Clardy, Jon
• Journal of publication: Acta Crystallographica Section A
• Year of publication: 2015
• Journal volume: 71
• Journal issue: 1
• a: 34.966 ± 0.003 Å
• b: 14.8683 ± 0.0014 Å
• c: 66.99 ± 0.006 Å
• α: 90°
• β: 104.191 ± 0.001°
• γ: 90°
• Cell volume: 33764 ± 5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 7
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0825
• Residual factor for significantly intense reflections: 0.0619
• Weighted residual factors for significantly intense reflections: 0.175
• Weighted residual factors for all reflections included in the refinement: 0.1909
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.41347 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes