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Information card for entry 7043915
Preview
Coordinates | 7043915.cif |
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Original paper (by DOI) | HTML |
Common name | Me-benz-Cu(II) complex |
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Formula | C23 H21 Cu F6 N5 O8 S2 |
Calculated formula | C23 H21 Cu F6 N5 O8 S2 |
SMILES | [Cu]12([OH2])([OH2])[n]3c4ccccc4n(C)c3c3[n]1c(ccc3)c1[n]2c2c(n1C)cccc2.S(=O)(=O)([O-])C(F)(F)F.S(=O)(=O)([O-])C(F)(F)F |
Title of publication | Copper(II)-Benzimidazole Complexes as an Efficient Fluorescent Probe for L-Cysteine in Water |
Authors of publication | Duraiyarasu, Maheshwaran; Selvaraj, Priyanga; Ramasamy, Mayilmurugan |
Journal of publication | Dalton Trans. |
Year of publication | 2017 |
a | 12.7225 ± 0.0006 Å |
b | 15.115 ± 0.0006 Å |
c | 17.1761 ± 0.0007 Å |
α | 85.831 ± 0.003° |
β | 68.352 ± 0.004° |
γ | 71.152 ± 0.004° |
Cell volume | 2901.3 ± 0.2 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100.15 K |
Number of distinct elements | 7 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0936 |
Residual factor for significantly intense reflections | 0.0841 |
Weighted residual factors for significantly intense reflections | 0.2377 |
Weighted residual factors for all reflections included in the refinement | 0.2493 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.043 |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
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/7043915.html
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Users of the data should acknowledge the original authors of the
structural data.