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Information card for entry 4078479
Preview
Coordinates | 4078479.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C41 H61 N O P Si2 Sm |
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Calculated formula | C41 H61 N O P Si2 Sm |
SMILES | [c]123[cH]4[cH]5[cH]6[cH]1[Sm]3456(C[Si](C)(C)C)(C[Si](C)(C)C)([N](c3c(cccc3C(C)C)C(C)C)=P2(c1ccccc1)c1ccccc1)[O]1CCCC1 |
Title of publication | Phosphazene-Functionalized Cyclopentadienyl and Its Derivatives Ligated Rare-Earth Metal Alkyl Complexes: Synthesis, Structures, and Catalysis on Ethylene Polymerization |
Authors of publication | Jian, Zhongbao; Petrov, Alex R.; Hangaly, Noa K.; Li, Shihui; Rong, Weifeng; Mou, Zehuai; Rufanov, Konstantin A.; Harms, Klaus; Sundermeyer, Jörg; Cui, Dongmei |
Journal of publication | Organometallics |
Year of publication | 2012 |
Journal volume | 31 |
Journal issue | 11 |
Pages of publication | 4267 |
a | 10.4379 ± 0.0008 Å |
b | 11.3382 ± 0.001 Å |
c | 18.9312 ± 0.0015 Å |
α | 102.768 ± 0.007° |
β | 103.164 ± 0.006° |
γ | 100.469 ± 0.007° |
Cell volume | 2063.1 ± 0.3 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 7 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1 |
Residual factor for significantly intense reflections | 0.048 |
Weighted residual factors for significantly intense reflections | 0.0884 |
Weighted residual factors for all reflections included in the refinement | 0.0973 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.712 |
Diffraction radiation wavelength | 0.71069 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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Users of the data should acknowledge the original authors of the
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