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Information card for entry 1512818
Preview
Coordinates | 1512818.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C43 H49 N4 O12 Ru2 S2 |
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Calculated formula | C43 H49 N4 O12 Ru2 S2 |
Title of publication | Sawhorse-type diruthenium tetracarbonyl complexes containing biologically relevant acids |
Authors of publication | Justin P. Johnpeter; Bruno Therrien |
Journal of publication | Inorganica Chimica Acta |
Year of publication | 2013 |
Journal volume | 394 |
Pages of publication | 723 - 728 |
a | 10.4848 ± 0.0006 Å |
b | 15.3189 ± 0.0011 Å |
c | 18.2466 ± 0.0012 Å |
α | 72.648 ± 0.005° |
β | 84.706 ± 0.005° |
γ | 73.398 ± 0.005° |
Cell volume | 2680.6 ± 0.3 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1472 |
Residual factor for significantly intense reflections | 0.091 |
Weighted residual factors for significantly intense reflections | 0.1523 |
Weighted residual factors for all reflections included in the refinement | 0.1734 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.131 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
176729 (current) | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1. |
1512818.cif |
120071 | 2014-07-11 | Adding DOIs to range 1 structures. | 1512818.cif |
90962 | 2013-11-21 | cif/ Adding structures of 1512818 via cif-deposit CGI script. |
1512818.cif |
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Users of the data should acknowledge the original authors of the
structural data.