Information card for entry 7045366

Structure parameters

• Formula: C6 Cs5 Mo3 N6 O Re3 Se8
• Calculated formula: C6 Cs5 Mo3 N6 O Re3 Se8
• Title of publication: Mixed-metal clusters with a {Re₃Mo₃Se₈} core: from a polymeric solid to soluble species with multiple redox transitions.
• Authors of publication: Muravieva, Viktoria K.; Gayfulin, Yakov M.; Ryzhikov, Maxim R.; Novozhilov, Igor N.; Samsonenko, Denis G.; Piryazev, Dmitry A.; Yanshole, Vadim V.; Naumov, Nikolay G.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 10
• Pages of publication: 3366 - 3377
• a: 9.9219 ± 0.0002 Å
• b: 9.9219 ± 0.0002 Å
• c: 19.6531 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 1675.53 ± 0.06 ų
• Cell temperature: 130 ± 2 K
• Ambient diffraction temperature: 130 ± 2 K
• Number of distinct elements: 7
• Space group number: 165
• Hermann-Mauguin space group symbol: P -3 c 1
• Hall space group symbol: -P 3 2"c
• Residual factor for all reflections: 0.0509
• Residual factor for significantly intense reflections: 0.0462
• Weighted residual factors for significantly intense reflections: 0.0922
• Weighted residual factors for all reflections included in the refinement: 0.0935
• Goodness-of-fit parameter for all reflections included in the refinement: 1.305
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No