Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4084958
Preview
| Coordinates | 4084958.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C80 H86 N16 O7 Zr2 |
|---|---|
| Calculated formula | C80 H86 N16 O7 Zr2 |
| Title of publication | Oxo-Bridged Bimetallic Group 4 Complexes Bearing Amine-Bis(benzotriazole phenolate) Derivatives as Bifunctional Catalysts for Ring-Opening Polymerization of Lactide and Copolymerization of Carbon Dioxide with Cyclohexene Oxide |
| Authors of publication | Su, Ching-Kai; Chuang, Hui-Ju; Li, Chen-Yu; Yu, Chun-Yue; Ko, Bao-Tsan; Chen, Jhy-Der; Chen, Ming-Jen |
| Journal of publication | Organometallics |
| Year of publication | 2014 |
| Journal volume | 33 |
| Journal issue | 24 |
| Pages of publication | 7091 |
| a | 14.8987 ± 0.0005 Å |
| b | 29.8415 ± 0.0009 Å |
| c | 16.9587 ± 0.0005 Å |
| α | 90° |
| β | 95.103 ± 0.002° |
| γ | 90° |
| Cell volume | 7509.9 ± 0.4 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0678 |
| Residual factor for significantly intense reflections | 0.042 |
| Weighted residual factors for significantly intense reflections | 0.0939 |
| Weighted residual factors for all reflections included in the refinement | 0.1051 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.014 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178738 (current) | 2016-03-21 | cif/4/08/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/08/49. |
4084958.cif |
| 131460 | 2015-02-07 | cif/ Updating files of 4084955, 4084956, 4084957, 4084958, 4084959 Original log message: Adding full bibliography for 4084955--4084959.cif. |
4084958.cif |
| 128446 | 2014-12-06 | cif/ Adding structures of 4084955, 4084956, 4084957, 4084958, 4084959 via cif-deposit CGI script. |
4084958.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.