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Information card for entry 7044581
Preview
Coordinates | 7044581.cif |
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Original paper (by DOI) | HTML |
Formula | C38 H37 Co N6 O5 S2 |
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Calculated formula | C38 H37 Co N6 O5 S2 |
SMILES | [Co]123([OH2])(n4cccc4C=[N]1c1ccccc1CN2S(=O)(=O)c1ccc(cc1)C)n1cccc1C=[N]3c1ccccc1CNS(=O)(=O)c1ccc(cc1)C |
Title of publication | Exploration of an Easily Synthesized Fluorescent Probe for Detecting Copper in Aqueous Samples |
Authors of publication | Sanmartin Matalobos, Jesus; Garcia-Deibe, Ana M.; Fondo, Matilde; Zarepour-Jevinani, Morteza; Domínguez-González, M. R.; Bermejo-Barrera, Pilar |
Journal of publication | Dalton Trans. |
Year of publication | 2017 |
a | 10.3758 ± 0.0009 Å |
b | 10.3171 ± 0.0008 Å |
c | 33.283 ± 0.003 Å |
α | 90° |
β | 97.525 ± 0.007° |
γ | 90° |
Cell volume | 3532.2 ± 0.5 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
Space group number | 7 |
Hermann-Mauguin space group symbol | P 1 c 1 |
Hall space group symbol | P -2yc |
Residual factor for all reflections | 0.1565 |
Residual factor for significantly intense reflections | 0.1245 |
Weighted residual factors for significantly intense reflections | 0.2683 |
Weighted residual factors for all reflections included in the refinement | 0.2951 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.193 |
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/7044581.html
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