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Information card for entry 7017306
Preview
Coordinates | 7017306.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C20 H24 N2 O S Zn |
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Calculated formula | C20 H24 N2 O S Zn |
SMILES | [Zn]1([N]2=C(c3c(N1c1ccccc1SC)cccc3)OCC2(C)C)CC |
Title of publication | Structural and catalytic studies of zinc complexes containing amido-oxazolinate ligands. |
Authors of publication | Chen, Ming-Tsz; Chen, Chi-Tien |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2011 |
Journal volume | 40 |
Journal issue | 48 |
Pages of publication | 12886 - 12894 |
a | 14.5692 ± 0.0011 Å |
b | 15.4862 ± 0.0012 Å |
c | 17.1701 ± 0.0013 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3873.9 ± 0.5 Å3 |
Cell temperature | 297 ± 2 K |
Ambient diffraction temperature | 297 ± 2 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 | 0.0809 |
Residual factor for significantly intense reflections | 0.0411 |
Weighted residual factors for significantly intense reflections | 0.0987 |
Weighted residual factors for all reflections included in the refinement | 0.1159 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.933 |
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/7017306.html
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