Information card for entry 4068833

Structure parameters

• Formula: C23 H29 N Zr
• Calculated formula: C23 H29 N Zr
• SMILES: [Zr]123456789(c%10c(cccc%10[C@H](C1)CC)CN(C)C)([cH]1[cH]2[cH]3[cH]4[cH]51)[cH]1[cH]9[cH]8[cH]7[cH]61
• Title of publication: Reactions of C,N-chelated Tin(II) and Lead(II) Compounds with Zirconocene Dichloride Derivatives
• Authors of publication: Bareš, Josef; Richard, Philippe; Meunier, Philippe; Pirio, Nadine; Padělková, Zdeňka; Černošek, Zdeněk; Císařová, Ivana; Růžička, Aleš
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 10
• Pages of publication: 3105
• a: 8.36 ± 0.0002 Å
• b: 14.514 ± 0.0003 Å
• c: 15.551 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1886.91 ± 0.08 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0391
• Residual factor for significantly intense reflections: 0.031
• Weighted residual factors for significantly intense reflections: 0.065
• Weighted residual factors for all reflections included in the refinement: 0.0689
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No