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Information card for entry 4067632
Preview
Coordinates | 4067632.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C44 H64 N7 Y |
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Calculated formula | C44 H64 N7 Y |
SMILES | [Y]1234(N(Cc5[n]1c(ccc5)CN2c1c(cccc1C(C)C)C(C)C)c1c(cccc1C(C)C)C(C)C)N(C)C=C[N]3=Cc1[n]4ccn1C.C(CCC)C |
Title of publication | Reactions of Aromatic N-Heterocycles with Yttrium and Lutetium Benzyl Complexes Supported by a Pyridine-Diamide Ligand |
Authors of publication | Jie, Suyun; Diaconescu, Paula L. |
Journal of publication | Organometallics |
Year of publication | 2010 |
Journal volume | 29 |
Journal issue | 5 |
Pages of publication | 1222 |
a | 15.316 ± 0.003 Å |
b | 16.488 ± 0.004 Å |
c | 18.773 ± 0.004 Å |
α | 68.659 ± 0.002° |
β | 78.608 ± 0.002° |
γ | 76.991 ± 0.002° |
Cell volume | 4267.3 ± 1.6 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1035 |
Residual factor for significantly intense reflections | 0.0565 |
Weighted residual factors for significantly intense reflections | 0.1278 |
Weighted residual factors for all reflections included in the refinement | 0.145 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.026 |
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/4067632.html
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Users of the data should acknowledge the original authors of the
structural data.