Information card for entry 2207072

Structure parameters

• Chemical name: trans-diiodotetrakis(tetrahydrofuran)calcium(II)
• Formula: C16 H32 Ca I2 O4
• Calculated formula: C16 H32 Ca I2 O4
• Title of publication: A low-temperature investigation of <i>trans</i>-diiodotetrakis(tetrahydrofuran)calcium(II)
• Authors of publication: Henderson, Kenneth W.; Rood, Jeffrey A.; Noll, Bruce C.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 10
• Pages of publication: m2006 - m2007
• a: 8.442 ± 0.002 Å
• b: 9.858 ± 0.002 Å
• c: 13.61 ± 0.003 Å
• α: 80.156 ± 0.001°
• β: 89.412 ± 0.001°
• γ: 87.877 ± 0.001°
• Cell volume: 1115.2 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.067
• Residual factor for significantly intense reflections: 0.058
• Weighted residual factors for significantly intense reflections: 0.158
• Weighted residual factors for all reflections included in the refinement: 0.171
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes