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Information card for entry 7207994
Preview
Coordinates | 7207994.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C16 H48 Cu2 I5 O8 S8 Tb |
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Calculated formula | C16 H48 Cu2 I5 O8 S8 Tb |
SMILES | CS(C)=[O][Tb]([O]=S(C)C)([O]=S(C)C)([O]=S(C)C)([O]=S(C)C)([O]=S(C)C)([O]=S(C)C)[O]=S(C)C.I[Cu]([I][Cu](I)I)I |
Title of publication | Solid-state structural transformations in metal organic-inorganic hybrids constructed from terbium(iii) complexes and iodocuprate clusters |
Authors of publication | Mishra, Shashank; Jeanneau, Erwann; Ledoux, Gilles; Daniele, Stéphane |
Journal of publication | CrystEngComm |
Year of publication | 2012 |
Journal volume | 14 |
Journal issue | 11 |
Pages of publication | 3894 |
a | 11.1937 ± 0.0005 Å |
b | 9.8578 ± 0.0002 Å |
c | 20.458 ± 0.0009 Å |
α | 90° |
β | 91.604 ± 0.002° |
γ | 90° |
Cell volume | 2256.56 ± 0.15 Å3 |
Cell temperature | 150 K |
Ambient diffraction temperature | 150 K |
Number of distinct elements | 7 |
Space group number | 13 |
Hermann-Mauguin space group symbol | P 1 2/n 1 |
Hall space group symbol | -P 2yac |
Residual factor for all reflections | 0.0669 |
Residual factor for significantly intense reflections | 0.0512 |
Weighted residual factors for all reflections | 0.1631 |
Weighted residual factors for significantly intense reflections | 0.1348 |
Weighted residual factors for all reflections included in the refinement | 0.1631 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.9636 |
Diffraction radiation wavelength | 0.71069 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/7207994.html
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