Information card for entry 4114316

Structure parameters

• Common name: [Mo2(DAniF)3]2(C16H14N2O2),2(CH2Cl2)
• Formula: C108 H108 Cl4 Mo4 N14 O16
• Calculated formula: C108.001 H104 Cl3.9992 Mo4 N14 O16
• Title of publication: Modifying Electronic Communication in Dimolybdenum Units by Linkage Isomers of Bridged Oxamidate Dianions
• Authors of publication: F. Albert Cotton; Chun Y. Liu; Carlos A. Murillo; Dino Villagrán; Xiaoping Wang
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2003
• Journal volume: 125
• Pages of publication: 13564 - 13575
• a: 30.833 ± 0.002 Å
• b: 12.4356 ± 0.0008 Å
• c: 28.0484 ± 0.0019 Å
• α: 90°
• β: 100.423 ± 0.001°
• γ: 90°
• Cell volume: 10577 ± 1.2 ų
• Cell temperature: 213 ± 2 K
• Ambient diffraction temperature: 213 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.049
• Residual factor for significantly intense reflections: 0.0375
• Weighted residual factors for significantly intense reflections: 0.0812
• Weighted residual factors for all reflections included in the refinement: 0.0881
• Goodness-of-fit parameter for all reflections included in the refinement: 1.082
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No