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Information card for entry 4064566
Preview
Coordinates | 4064566.cif |
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Original paper (by DOI) | HTML |
Formula | C47 H64 Cl4 N4 Nb2 O6 |
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Calculated formula | C47 H64 Cl4 N4 Nb2 O6 |
Title of publication | NCN-Pincer Metal Complexes (Ti, Cr, V, Zr, Hf, and Nb) of the Phebox Ligand (S,S)-2,6-Bis(4′-isopropyl-2′-oxazolinyl)phenyl |
Authors of publication | Chuchuryukin, Alexey V.; Huang, Rubin; Lutz, Martin; Chadwick, John C.; Spek, Anthony L.; van Koten, Gerard |
Journal of publication | Organometallics |
Year of publication | 2011 |
Journal volume | 30 |
Journal issue | 10 |
Pages of publication | 2819 |
a | 11.1179 ± 0.0001 Å |
b | 18.6083 ± 0.0001 Å |
c | 24.8042 ± 0.0002 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 5131.62 ± 0.07 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 6 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.0371 |
Residual factor for significantly intense reflections | 0.0289 |
Weighted residual factors for significantly intense reflections | 0.0648 |
Weighted residual factors for all reflections included in the refinement | 0.0679 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.032 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4064566.html
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Users of the data should acknowledge the original authors of the
structural data.