Information card for entry 7232839

Structure parameters

• Formula: C27 H23 Mo2 N5 O9
• Calculated formula: C27 H23 Mo2 N5 O9
• Title of publication: Molecular chains of coordinated dimolybdenum isonicotinate paddlewheel clusters
• Authors of publication: Li, Minyuan M.; Claire, F. James; Solomos, Marina A.; Tenney, Stephanie M.; Ivanov, Sergei A.; Siegler, Maxime A.; Kempa, Thomas J.
• Journal of publication: RSC Advances
• Year of publication: 2019
• Journal volume: 9
• Journal issue: 29
• Pages of publication: 16492
• a: 8.5571 ± 0.0003 Å
• b: 11.9579 ± 0.0005 Å
• c: 15.1881 ± 0.0005 Å
• α: 111.799 ± 0.003°
• β: 92.248 ± 0.003°
• γ: 99.262 ± 0.003°
• Cell volume: 1415.84 ± 0.1 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 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: 0.0508
• Residual factor for significantly intense reflections: 0.0328
• Weighted residual factors for significantly intense reflections: 0.0564
• Weighted residual factors for all reflections included in the refinement: 0.062
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No