Information card for entry 7005123

Structure parameters

• Formula: C26 H60 N8 Zr
• Calculated formula: C26 H60 N8 Zr
• SMILES: [Zr]12([N](C(C)C)=C(N(C)CC)N2C(C)C)([N](C(C)C)=C(N(C)CC)N1C(C)C)(N(CC)C)N(CC)C
• Title of publication: Synthesis and characterisation of zirconium-amido guanidinato complex: a potential precursor for ZrO2 thin films.
• Authors of publication: Devi, Anjana; Bhakta, Raghunandan; Milanov, Andrian; Hellwig, Malte; Barreca, Davide; Tondello, Eugene; Thomas, Reji; Ehrhart, Peter; Winter, Manuela; Fischer, Roland
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 17
• Pages of publication: 1671 - 1676
• a: 10.8201 ± 0.0018 Å
• b: 17.638 ± 0.002 Å
• c: 33.626 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6417.4 ± 1.6 ų
• Cell temperature: 105 ± 2 K
• Ambient diffraction temperature: 105 ± 2 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.1809
• Residual factor for significantly intense reflections: 0.0634
• Weighted residual factors for significantly intense reflections: 0.0967
• Weighted residual factors for all reflections included in the refinement: 0.1353
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No