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Information card for entry 7117530
Preview
Coordinates | 7117530.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C23 H26 Cl N O5 Pt S |
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Calculated formula | C23 H26 Cl N O5 Pt S |
SMILES | c12[Pt](Cl)([n]3c(c2cccc1)cc(c1ccccc31)C(=O)OCCOCCOC)[S](C)(C)=O |
Title of publication | Water soluble, cyclometalated Pt(II)-Ln(III) conjugates towards novel bimodal imaging agents |
Authors of publication | Oliver J. Stacey; Angelo J. Amoroso; James A. Platts; Peter N. Horton; Simon J. Coles; David Lloyd; Catrin F. Williams; Anthony J. Hayes; Jay J. Dunsford; Simon J. A. Pope |
Journal of publication | Chem.Commun. |
Year of publication | 2015 |
Journal volume | 51 |
Pages of publication | 12305 |
a | 9.583 ± 0.0007 Å |
b | 9.8654 ± 0.0007 Å |
c | 14.2517 ± 0.001 Å |
α | 104.643 ± 0.004° |
β | 95.718 ± 0.003° |
γ | 114.866 ± 0.004° |
Cell volume | 1149.74 ± 0.15 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 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 | 0.0245 |
Residual factor for significantly intense reflections | 0.0237 |
Weighted residual factors for significantly intense reflections | 0.0619 |
Weighted residual factors for all reflections included in the refinement | 0.0623 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.061 |
Diffraction radiation wavelength | 0.71075 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/7117530.html
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Users of the data should acknowledge the original authors of the
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