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Information card for entry 7035874
Preview
Coordinates | 7035874.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C72 H52 Br6 N4 Nd2 O18 |
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Calculated formula | C72 H52 Br6 N4 Nd2 O18 |
SMILES | C1(c2c(ccc(c2)OC)Br)=[O][Nd]23456([n]7cccc8c7c7[n]2cccc7cc8)([O]1[Nd]127([O]=C(O3)c3c(Br)ccc(OC)c3)([n]3cccc8c3c3[n]1cccc3cc8)([O]=C(c1c(ccc(c1)OC)Br)[O]52)(OC(=[O]6)c1c(Br)ccc(OC)c1)[O]=C(O7)c1c(Br)ccc(OC)c1)[O]=C(O4)c1c(Br)ccc(c1)OC |
Title of publication | Preparation, characterization and properties of four new trivalent lanthanide complexes constructed using 2-bromine-5-methoxybenzoic acid and 1,10-phenanthroline. |
Authors of publication | Zong, Guang-Cai; Huo, Jian-Xia; Ren, Ning; Zhang, Jian-Jun; Qi, Xiao-Xia; Gao, Jie; Geng, Li-Na; Wang, Shu-Ping; Shi, Shi-Kao |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2015 |
Journal volume | 44 |
Journal issue | 33 |
Pages of publication | 14877 - 14886 |
a | 12.4699 ± 0.0012 Å |
b | 13.2334 ± 0.0013 Å |
c | 13.5944 ± 0.0013 Å |
α | 61.105 ± 0.001° |
β | 69.682 ± 0.002° |
γ | 71.28 ± 0.002° |
Cell volume | 1809.5 ± 0.3 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1839 |
Residual factor for significantly intense reflections | 0.0897 |
Weighted residual factors for significantly intense reflections | 0.1175 |
Weighted residual factors for all reflections included in the refinement | 0.1613 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.981 |
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/7035874.html
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