Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4073892
Preview
| Coordinates | 4073892.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C22 H32 Br2 Cl2 N2 O2 Pt2 |
|---|---|
| Calculated formula | C22 H32 Br2 Cl2 N2 O2 Pt2 |
| SMILES | [n]1([Pt]23(C(OCCCC)(C)[Pt]3([n]3c(Br)cccc3)(C2(OCCCC)C)Cl)Cl)c(Br)cccc1 |
| Title of publication | Polymeric Alkylidene-Bridged Platinum Complex [{Pt2(μ-Cl)2{μ-C(OBu)Me}2}n]: Synthesis, Reactivity, and Quantum Chemical Calculations |
| Authors of publication | Albrecht, Christian; Schwieger, Sebastian; Rüffer, Tobias; Bruhn, Clemens; Lis, Tadeusz; Steinborn, Dirk |
| Journal of publication | Organometallics |
| Year of publication | 2007 |
| Journal volume | 26 |
| Journal issue | 24 |
| Pages of publication | 6000 |
| a | 8.368 ± 0.003 Å |
| b | 8.452 ± 0.003 Å |
| c | 10.835 ± 0.003 Å |
| α | 103.28 ± 0.03° |
| β | 92.23 ± 0.03° |
| γ | 113.92 ± 0.03° |
| Cell volume | 674.2 ± 0.4 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.027 |
| Residual factor for significantly intense reflections | 0.0249 |
| Weighted residual factors for significantly intense reflections | 0.0625 |
| Weighted residual factors for all reflections included in the refinement | 0.0632 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.028 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178627 (current) | 2016-03-21 | cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/38. |
4073892.cif |
| 120075 | 2014-07-11 | Adding DOIs to range 4/07 structures. | 4073892.cif |
| 47256 | 2012-03-23 | cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories. |
4073892.cif |
| 46611 | 2012-03-21 | ../uploads/cif-deposit/cod/cif Adding structures of 4073890, 4073891, 4073892, 4073893, 4073894 via cif-deposit CGI script. |
4073892.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.