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Information card for entry 4114557
Preview
Coordinates | 4114557.cif |
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Original paper (by DOI) | HTML |
Formula | C28 H47 B3 O4 Ru2 |
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Calculated formula | C28 H47 B3 O4 Ru2 |
Title of publication | Ruthenacarboranes from the Reaction of nido-1,2-(Cp*RuH)2B3H7with HC\τbCCO2Me, Cp* = η5-C5Me5. Hydrometalation, Alkyne Incorporation, and Functional Group Modification via Cooperative Metal-Boron Interactions within a Metallaborane Cluster Framework |
Authors of publication | Hong Yan; Alicia M. Beatty; Thomas P. Fehlner |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2003 |
Journal volume | 125 |
Pages of publication | 16367 - 16382 |
a | 8.576 ± 0.0004 Å |
b | 10.5548 ± 0.0005 Å |
c | 18.5784 ± 0.0009 Å |
α | 73.699 ± 0.001° |
β | 83.985 ± 0.001° |
γ | 66.936 ± 0.001° |
Cell volume | 1485.03 ± 0.12 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0518 |
Residual factor for significantly intense reflections | 0.0441 |
Weighted residual factors for significantly intense reflections | 0.0959 |
Weighted residual factors for all reflections included in the refinement | 0.0999 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.068 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
178916 (current) | 2016-03-22 | cif/4/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/11/45. |
4114557.cif |
120077 | 2014-07-12 | Adding DOIs to range 4/11 structures. | 4114557.cif |
67885 | 2012-10-05 | cif/ Adding structures of 4114557 via cif-deposit CGI script. |
4114557.cif |
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Users of the data should acknowledge the original authors of the
structural data.