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Information card for entry 4080305
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Coordinates | 4080305.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | [Sm(DippForm)Br2(THF)3] |
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Formula | C44 H67 Br2 N2 O3 Sm |
Calculated formula | C44 H67 Br2 N2 O3 Sm |
SMILES | [Sm]1(Br)([O]2CCCC2)(N(C=[N]1c1c(cccc1C(C)C)C(C)C)c1c(cccc1C(C)C)C(C)C)(Br)([O]1CCCC1)[O]1CCCC1.Cc1ccccc1 |
Title of publication | Bulky Formamidinate-Supported Lanthanoid Halides and Alkyls, Including a Rare Terminal La‒Me Species |
Authors of publication | Cole, Marcus L.; Deacon, Glen B.; Junk, Peter C.; Wang, Jun |
Journal of publication | Organometallics |
Year of publication | 2013 |
Journal volume | 32 |
Journal issue | 5 |
Pages of publication | 1370 |
a | 19.5632 ± 0.0003 Å |
b | 19.1357 ± 0.0003 Å |
c | 23.8446 ± 0.0004 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 8926.4 ± 0.2 Å3 |
Cell temperature | 123 ± 1 K |
Ambient diffraction temperature | 123 ± 1 K |
Number of distinct elements | 6 |
Space group number | 61 |
Hermann-Mauguin space group symbol | P b c a |
Hall space group symbol | -P 2ac 2ab |
Residual factor for all reflections | 0.0724 |
Residual factor for significantly intense reflections | 0.0379 |
Weighted residual factors for significantly intense reflections | 0.0822 |
Weighted residual factors for all reflections included in the refinement | 0.0936 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.978 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4080305.html
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Users of the data should acknowledge the original authors of the
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