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Information card for entry 4326932
Preview
Coordinates | 4326932.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C40 H56 B N8 Y |
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Calculated formula | C40 H56 B N8 Y |
SMILES | [Y]1234567([n]8n([BH](n9[n]1c(C)cc9C)n1[n]2c(C)cc1C)c(cc8C)C)([N](=C(N3C1CCCCC1)Cc1ccccc1)C1CCCCC1)[cH]1[cH]4[cH]7[cH]6[cH]51 |
Title of publication | Synthesis, Structures, and Reactivity of Yttrium Alkyl and Alkynyl Complexes with Mixed TpMe2/Cp Ligands |
Authors of publication | Weiyin Yi; Jie Zhang; Meng Li; Zhenxia Chen; Xigeng Zhou |
Journal of publication | Inorganic Chemistry |
Year of publication | 2011 |
Journal volume | 50 |
Pages of publication | 11813 - 11824 |
a | 10.71 ± 0.005 Å |
b | 10.896 ± 0.005 Å |
c | 19.137 ± 0.008 Å |
α | 76.941 ± 0.006° |
β | 75.218 ± 0.006° |
γ | 66.994 ± 0.005° |
Cell volume | 1967.5 ± 1.5 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 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 | 0.0686 |
Residual factor for significantly intense reflections | 0.0415 |
Weighted residual factors for significantly intense reflections | 0.08 |
Weighted residual factors for all reflections included in the refinement | 0.0881 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.907 |
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/4326932.html
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Users of the data should acknowledge the original authors of the
structural data.