Information card for entry 4318574

Structure parameters

• Common name: complex 4, Ce(tBuMeMe)3
• Formula: C33 H60 Ce N3 O6
• Calculated formula: C33 H60 Ce N3 O6
• SMILES: [Ce]12345(OC(=CC(=[N]3CC[O]1C)C)C(C)(C)C)(OC(=CC(=[N]4CC[O]2C)C)C(C)(C)C)OC(=CC(=[N]5CCOC)C)C(C)(C)C
• Title of publication: Synthesis and Characterization of Volatile, Fluorine-Free β-Ketoiminate Lanthanide MOCVD Precursors and Their Implementation in Low-Temperature Growth of Epitaxial CeO2 Buffer Layers for Superconducting Electronics
• Authors of publication: Nikki L. Edleman; Anchuan Wang; John A. Belot; Andrew W. Metz; Jason R. Babcock; Amber M. Kawaoka; Jun Ni; Matthew V. Metz; Christine J. Flaschenriem; Charlotte L. Stern; Louise M. Liable-Sands; Arnold L. Rheingold; Paul R. Markworth; Robert P. H. Chang; Michael P. Chudzik; Carl R. Kannewurf; Tobin J. Marks
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 5005 - 5023
• a: 17.504 ± 0.0002 Å
• b: 21.1598 ± 0.0002 Å
• c: 23.0715 ± 0.0002 Å
• α: 112.885 ± 0.0006°
• β: 90.9699 ± 0.0011°
• γ: 99.5012 ± 0.0007°
• Cell volume: 7733.61 ± 0.14 ų
• Cell temperature: 198 ± 2 K
• Ambient diffraction temperature: 198 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0884
• Residual factor for significantly intense reflections: 0.0528
• Weighted residual factors for significantly intense reflections: 0.1157
• Weighted residual factors for all reflections included in the refinement: 0.1326
• Goodness-of-fit parameter for all reflections included in the refinement: 1.12
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No