Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4335492
Preview
Coordinates | 4335492.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | (ONO)ReO(PPh3) |
---|---|
Chemical name | Oxo(triphenylphosphine)(bis(3,5-di-tert-butyl-2-phenoxo)amido)rhenium(V) |
Formula | C46 H55 N O3 P Re |
Calculated formula | C46 H55 N O3 P Re |
Title of publication | Nonclassical Oxygen Atom Transfer as a Synthetic Strategy: Preparation of an Oxorhenium(V) Complex of the Bis(3,5-di-tert-butyl-2-phenoxo)amide Ligand |
Authors of publication | Daniel D. Wright; Seth N. Brown |
Journal of publication | Inorganic Chemistry |
Year of publication | 2013 |
Journal volume | 52 |
Pages of publication | 7831 - 7833 |
a | 10.162 ± 0.0006 Å |
b | 14.7652 ± 0.0009 Å |
c | 28.6116 ± 0.0018 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 4293 ± 0.5 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120 ± 2 K |
Number of distinct elements | 6 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.024 |
Residual factor for significantly intense reflections | 0.0204 |
Weighted residual factors for significantly intense reflections | 0.0381 |
Weighted residual factors for all reflections included in the refinement | 0.0387 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.017 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
179457 (current) | 2016-03-23 | cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/54. |
4335492.cif |
101422 | 2014-02-13 | cif/ Adding structures of 4335492 via cif-deposit CGI script. |
4335492.cif |
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.