Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7036505
Preview
Coordinates | 7036505.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C40 H39 Dy0.89 N8 O11 S2 Zn2 |
---|---|
Calculated formula | C40 H39 Dy0.89 N8 O11 S2 Zn2 |
Title of publication | Structural switching from paramagnetic to single-molecule magnet behaviour of LnZn2 trinuclear complexes. |
Authors of publication | Then, Poh Ling; Takehara, Chika; Kataoka, Yumiko; Nakano, Motohiro; Yamamura, Tomoo; Kajiwara, Takashi |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2015 |
Journal volume | 44 |
Journal issue | 41 |
Pages of publication | 18038 - 18048 |
a | 12.0861 ± 0.0014 Å |
b | 12.5884 ± 0.0017 Å |
c | 16.352 ± 0.002 Å |
α | 87.747 ± 0.005° |
β | 69.486 ± 0.004° |
γ | 70.587 ± 0.004° |
Cell volume | 2189.2 ± 0.5 Å3 |
Cell temperature | 153 ± 2 K |
Ambient diffraction temperature | 153 ± 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 | 0.0416 |
Residual factor for significantly intense reflections | 0.0385 |
Weighted residual factors for significantly intense reflections | 0.0995 |
Weighted residual factors for all reflections included in the refinement | 0.1019 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.051 |
Diffraction radiation wavelength | 0.71075 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
176428 (current) | 2016-02-13 | Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively. |
7036505.cif |
171183 | 2015-12-09 | cif/ Updating files of 7036501, 7036502, 7036503, 7036504, 7036505 Original log message: Adding full bibliography for 7036501--7036505.cif. |
7036505.cif |
156311 | 2015-09-15 | cif/ Adding structures of 7036501, 7036502, 7036503, 7036504, 7036505 via cif-deposit CGI script. |
7036505.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.