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Information card for entry 7016713
Preview
Coordinates | 7016713.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C40 H68 N6 Si4 Sm2 |
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Calculated formula | C40 H68 N6 Si4 Sm2 |
SMILES | c12C(c3[n]45[Sm]67([n]82c(C(c2[n]96c(C(C)(c6ccc(C(c4cc3)(C)C)[n]76[Sm]589N([Si](C)(C)C)[Si](C)(C)C)C)cc2)(C)C)cc1)N([Si](C)(C)C)[Si](C)(C)C)(C)C |
Title of publication | Synthesis, structure and catalytic activity of alkali metal-free bent-sandwiched lanthanide amido complexes with calix[4]-pyrrolyl ligands. |
Authors of publication | Zhou, Shuangliu; Wu, Shihong; Zhu, Hong; Wang, Shaowu; Zhu, Xiancui; Zhang, Lijun; Yang, Gaosheng; Cui, Daohui; Wang, Hengyu |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2011 |
Journal volume | 40 |
Journal issue | 37 |
Pages of publication | 9447 - 9453 |
a | 16.2516 ± 0.0009 Å |
b | 13.0822 ± 0.0007 Å |
c | 23.026 ± 0.0013 Å |
α | 90° |
β | 106.049 ± 0.001° |
γ | 90° |
Cell volume | 4704.7 ± 0.4 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
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 | 0.0286 |
Residual factor for significantly intense reflections | 0.0229 |
Weighted residual factors for significantly intense reflections | 0.0572 |
Weighted residual factors for all reflections included in the refinement | 0.061 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.077 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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