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Information card for entry 7059075
Preview
Coordinates | 7059075.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C14 H14 Co N4 O2 S2 |
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Calculated formula | C14 H14 Co N4 O2 S2 |
Title of publication | Exploring solvent dependent catecholase activity in transition metal complexes: an experimental and theoretical approach |
Authors of publication | I., Mantasha; Shahid, M.; Kumar, Manjeet; Ansari, Azaj; Akhtar, Muhammad Nadeem; AlDamen, Murad A.; Song, You; Ahmad, Musheer; Khan, Ishaat M. |
Journal of publication | New Journal of Chemistry |
Year of publication | 2020 |
Journal volume | 44 |
Journal issue | 4 |
Pages of publication | 1371 - 1388 |
a | 11.4021 ± 0.0003 Å |
b | 8.2603 ± 0.0002 Å |
c | 17.7971 ± 0.0005 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1676.22 ± 0.08 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 6 |
Space group number | 60 |
Hermann-Mauguin space group symbol | P b c n |
Hall space group symbol | -P 2n 2ab |
Residual factor for all reflections | 0.0314 |
Residual factor for significantly intense reflections | 0.0242 |
Weighted residual factors for significantly intense reflections | 0.0579 |
Weighted residual factors for all reflections included in the refinement | 0.0617 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.041 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7059075.html
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structural data.