Information card for entry 7049184

Structure parameters

• Chemical name: bis(cyclopentadienylnickel)pentalenyl
• Formula: C24 H28 Ni2
• Calculated formula: C24 H28 Ni2
• Title of publication: Synthesis, characterisation and redox properties of anti-bimetallic permethylpentalene complexes.
• Authors of publication: Binding, Samantha C.; Green, Jennifer C.; Turner, Zoë R; Buffet, Jean-Charles; O'Hare, Dermot
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 13
• Pages of publication: 4263 - 4273
• a: 7.6274 ± 0.0004 Å
• b: 8.2173 ± 0.0004 Å
• c: 9.6561 ± 0.0007 Å
• α: 68.6 ± 0.003°
• β: 87.71 ± 0.003°
• γ: 62.426 ± 0.004°
• Cell volume: 493.35 ± 0.06 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0441
• Residual factor for significantly intense reflections: 0.0403
• Weighted residual factors for all reflections: 0.1017
• Weighted residual factors for significantly intense reflections: 0.0984
• Weighted residual factors for all reflections included in the refinement: 0.1017
• Goodness-of-fit parameter for all reflections included in the refinement: 0.8807
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No