Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7041133
Preview
Coordinates | 7041133.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C162 H138 N14 O24 Tb4 |
---|---|
Calculated formula | C162 H138 N14 O24 Tb4 |
SMILES | c12c3ccc4[n]1[Tb]156([N](=C4)N4[Tb]789([O]=C(c%10ccccc%10)C=C(O8)c8ccccc8)(OC(=CC(=[O]7)c7ccccc7)c7ccccc7)(OC(=CC(c7ccccc7)=[O]9)c7ccccc7)[N](=C(C4=[O]5)C)O)([O]=C(C=C(O6)c4ccccc4)c4ccccc4)([O](c2ccc3)[Tb]2345([n]6c7c(cccc7ccc6C=[N]2N2C(=[O]4)C(=[N](O)[Tb]4672(OC(=CC(=[O]4)c2ccccc2)c2ccccc2)(OC(=CC(=[O]6)c2ccccc2)c2ccccc2)[O]=C(c2ccccc2)C=C(c2ccccc2)O7)C)[O]13)(OC(=CC(=[O]5)c1ccccc1)c1ccccc1)[OH]CC)[OH]CC.N#CC.N#CC.N#CC.N#CC.N#CC.N#CC |
Title of publication | Modulation of the relaxation dynamics of linear-shaped tetranuclear rare-earth clusters through utilizing different solvents. |
Authors of publication | Zhang, Ru-Xia; Chang, Yi-Xin; Shen, Hai-Yun; Wang, Wen-Min; Zhou, Xiao-Pu; Wang, Ni-Ni; Cui, Jian-Zhong; Gao, Hong-Ling |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2016 |
Journal volume | 45 |
Journal issue | 47 |
Pages of publication | 19117 - 19126 |
a | 17.345 ± 0.002 Å |
b | 23.547 ± 0.002 Å |
c | 18.849 ± 0.002 Å |
α | 90° |
β | 105.937 ± 0.002° |
γ | 90° |
Cell volume | 7402.5 ± 1.3 Å3 |
Cell temperature | 113 K |
Ambient diffraction temperature | 113 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 | 0.1253 |
Residual factor for significantly intense reflections | 0.0628 |
Weighted residual factors for significantly intense reflections | 0.1339 |
Weighted residual factors for all reflections included in the refinement | 0.1638 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.055 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7041133.html
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.