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Information card for entry 4078289
Preview
Coordinates | 4078289.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C39 H63 Al2 N2 Sc |
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Calculated formula | C39 H63 Al2 N2 Sc |
SMILES | C1(c2ccccc2)=[N](c2c(cccc2C(C)C)C(C)C)[Sc]23([CH3][Al]([CH3]2)(C)C)(N1c1c(cccc1C(C)C)C(C)C)[CH3][Al]([CH3]3)(C)C |
Title of publication | Unusual Si‒H Bond Activation and Formation of Cationic Scandium Amide Complexes from a Mono(amidinate)-Ligated Scandium Bis(silylamide) Complex and Their Performance in Isoprene Polymerization |
Authors of publication | Chen, Fei; Fan, Shimin; Wang, Yibin; Chen, Jue; Luo, Yunjie |
Journal of publication | Organometallics |
Year of publication | 2012 |
Journal volume | 31 |
Journal issue | 9 |
Pages of publication | 3730 |
a | 17.497 ± 0.006 Å |
b | 13.674 ± 0.004 Å |
c | 17.26 ± 0.006 Å |
α | 90° |
β | 93.728 ± 0.008° |
γ | 90° |
Cell volume | 4121 ± 2 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 | 0.1021 |
Residual factor for significantly intense reflections | 0.0935 |
Weighted residual factors for significantly intense reflections | 0.2251 |
Weighted residual factors for all reflections included in the refinement | 0.2307 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.147 |
Diffraction radiation wavelength | 0.7107 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4078289.html
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