Information card for entry 2243141

Structure parameters

• Chemical name: <i>p</i>-Phenylenediammonium octa-μ~3~-chlorido-hexachlorido-<i>octahedro</i>-hexamolybdate <i>N</i>,<i>N</i>-dimethylformamide hexasolvate
• Formula: C24 H52 Cl14 Mo6 N8 O6
• Calculated formula: C24 H52 Cl14 Mo6 N8 O6
• Title of publication: Crystal structures and hydrogen-bonding analysis of a series of solvated ammonium salts of molybdenum(II) chloride clusters
• Authors of publication: Johnston, Dean H.; Agho, Ikponmwosa
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2019
• Journal volume: 75
• Journal issue: 11
• Pages of publication: 1705 - 1711
• a: 10.1752 ± 0.0016 Å
• b: 10.3227 ± 0.0016 Å
• c: 13.736 ± 0.002 Å
• α: 95.204 ± 0.004°
• β: 111.483 ± 0.004°
• γ: 101.973 ± 0.004°
• Cell volume: 1291.1 ± 0.3 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.037
• Residual factor for significantly intense reflections: 0.0259
• Weighted residual factors for significantly intense reflections: 0.0576
• Weighted residual factors for all reflections included in the refinement: 0.0621
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes