Information card for entry 7102785

Structure parameters

• Common name: (MO2(DAniF)3)2(trans-C8H8N2O2).4CH2Cl2
• Formula: C102 H106 Cl8 Mo4 N14 O14
• Calculated formula: C101.274 H104.548 Cl6.548 Mo4 N14 O14
• Title of publication: Exceptionally strong electronic coupling between [Mo2] units linked by substituted dianionic quinones
• Authors of publication: Cotton, F. Albert; Jin, Jia-Yi; Li, Zhong; Murillo, Carlos A.; Reibenspies, Joseph H.
• Journal of publication: Chemical Communications (Cambridge, United Kingdom)
• Year of publication: 2008
• Journal issue: 2
• Pages of publication: 211 - 213
• a: 11.345 ± 0.004 Å
• b: 16.008 ± 0.006 Å
• c: 16.851 ± 0.006 Å
• α: 70.111 ± 0.007°
• β: 73.723 ± 0.006°
• γ: 70.823 ± 0.006°
• Cell volume: 2668.7 ± 1.7 ų
• Cell temperature: 213 ± 2 K
• Ambient diffraction temperature: 213 ± 2 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: 0.0907
• Residual factor for significantly intense reflections: 0.0615
• Weighted residual factors for significantly intense reflections: 0.1586
• Weighted residual factors for all reflections included in the refinement: 0.1809
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No