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Information card for entry 7715534
Preview
Coordinates | 7715534.cif |
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Original paper (by DOI) | HTML |
Formula | C15 H35 Cu F9 N4 O9.5 P3 |
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Calculated formula | C15 H35 Cu F9 N4 O9.5 P3 |
Title of publication | Transition metal complexes of the (2,2,2-trifluoroethyl)phosphinate NOTA analogue as potential contrast agents for <sup>19</sup>F magnetic resonance imaging. |
Authors of publication | Koucký, Filip; Dobrovolná, Tereza; Kotek, Jan; Císařová, Ivana; Havlíčková, Jana; Liška, Alan; Kubíček, Vojtěch; Hermann, Petr |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2024 |
Journal volume | 53 |
Journal issue | 22 |
Pages of publication | 9267 - 9285 |
a | 25.5776 ± 0.001 Å |
b | 9.4016 ± 0.0003 Å |
c | 24.4262 ± 0.0008 Å |
α | 90° |
β | 101.072 ± 0.001° |
γ | 90° |
Cell volume | 5764.4 ± 0.3 Å3 |
Cell temperature | 180 ± 2 K |
Ambient diffraction temperature | 180 ± 2 K |
Number of distinct elements | 7 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0291 |
Residual factor for significantly intense reflections | 0.0272 |
Weighted residual factors for significantly intense reflections | 0.0739 |
Weighted residual factors for all reflections included in the refinement | 0.0753 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.032 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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