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Information card for entry 7110829
Preview
Coordinates | 7110829.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | (triphenylphosphine)(sigma-allyl)bis(pi-allyl)iridium |
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Formula | C54 H60 Ir2 P2 |
Calculated formula | C27 H28 Ir P |
Title of publication | Chemistry of M(allyl)3 (M = Rh, Ir) compounds: structural characterization of tris(allyl)iridium complexes with phosphorus ligands |
Authors of publication | John, Kevin D.; Scott, Brian L.; Baker, R. Thomas; Sattelberger, Alfred P.; Salazar, Kenneth V. |
Journal of publication | Chemical Communications |
Year of publication | 2000 |
Journal issue | 7 |
Pages of publication | 581 |
a | 9.2972 ± 0.0004 Å |
b | 15.7287 ± 0.0007 Å |
c | 16.6995 ± 0.0008 Å |
α | 73.249 ± 0.001° |
β | 82.344 ± 0.001° |
γ | 79.303 ± 0.001° |
Cell volume | 2289.49 ± 0.18 Å3 |
Cell temperature | 203 ± 2 K |
Ambient diffraction temperature | 203 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0319 |
Residual factor for significantly intense reflections | 0.0262 |
Weighted residual factors for significantly intense reflections | 0.0645 |
Weighted residual factors for all reflections included in the refinement | 0.067 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.999 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
180222 (current) | 2016-03-26 | cif/7/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/11/08. |
7110829.cif |
95948 | 2014-01-28 | cif/ Adding structures of 7110829, 7110830, 7110831 via cif-deposit CGI script. |
7110829.cif |
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Users of the data should acknowledge the original authors of the
structural data.