Information card for entry 7044836

Structure parameters

• Formula: C45 H41 Mo2 O9 P3
• Calculated formula: C45 H41 Mo2 O9 P3
• Title of publication: Accessing Multimetallic Complexes with a Phosphorus(I) Zwitterion
• Authors of publication: Kosnik, Stephanie C.; Nascimento, Maxemilian C.; Binder, Justin Frank; Macdonald, Charles L. B.
• Journal of publication: Dalton Transactions
• Year of publication: 2017
• a: 12.0912 ± 0.0004 Å
• b: 20.0536 ± 0.0006 Å
• c: 37.1612 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 9010.6 ± 0.5 ų
• Cell temperature: 170 ± 2 K
• Ambient diffraction temperature: 170 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0448
• Residual factor for significantly intense reflections: 0.0318
• Weighted residual factors for significantly intense reflections: 0.0687
• Weighted residual factors for all reflections included in the refinement: 0.0725
• 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