Information card for entry 7021337

Structure parameters

• Formula: C133.5 H170 Nb2 O5
• Calculated formula: C123 H156 Nb2 O5
• Title of publication: Reduction of carbon monoxide by a tetrakis(aryloxide)diniobium complex having four bridging hydrides.
• Authors of publication: Kurogi, Takashi; Ishida, Yutaka; Hatanaka, Tsubasa; Kawaguchi, Hiroyuki
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 21
• Pages of publication: 7510 - 7513
• a: 20.333 ± 0.003 Å
• b: 25.833 ± 0.005 Å
• c: 21.541 ± 0.004 Å
• α: 90°
• β: 90.185 ± 0.003°
• γ: 90°
• Cell volume: 11315 ± 3 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 4
• 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: 0.1029
• Residual factor for significantly intense reflections: 0.0803
• Weighted residual factors for significantly intense reflections: 0.1988
• Weighted residual factors for all reflections included in the refinement: 0.2148
• Goodness-of-fit parameter for all reflections included in the refinement: 1.109
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No