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Information card for entry 7229173
Preview
Coordinates | 7229173.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C56 H52 Cl10 Dy2 N8 O6 |
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Calculated formula | C56 H52 Cl10 Dy2 N8 O6 |
SMILES | c12c([O]3[Dy]45678[N](CCN9CC[N]%10(C29)CC[N]2=Cc9c(O[Dy]%11%123%102[N](CCN2CC[N]6(CC[N]5=Cc3c(O8)ccc(c3)Cl)C2c2c([O]7%11)ccc(c2)Cl)=Cc2cc(ccc2O%12)Cl)ccc(c9)Cl)=Cc2cc(ccc2O4)Cl)ccc(c1)Cl.C(Cl)Cl.C(Cl)Cl |
Title of publication | Solvent orientation in the crystal lattice producing distinct magnetic dynamics in two binuclear Dy(iii) polymorphs with a polydentate Schiff base ligand |
Authors of publication | Jiang, Zhijie; Sun, Lin; Yang, Qi; Wei, Shilong; Ke, Hongshan; Chen, Sanping; Zhang, Yiquan; Wei, Qing; Xie, Gang |
Journal of publication | CrystEngComm |
Year of publication | 2017 |
a | 21.186 ± 0.009 Å |
b | 15.093 ± 0.009 Å |
c | 21.803 ± 0.012 Å |
α | 90° |
β | 116.915 ± 0.014° |
γ | 90° |
Cell volume | 6217 ± 6 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 6 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.076 |
Residual factor for significantly intense reflections | 0.0494 |
Weighted residual factors for significantly intense reflections | 0.1162 |
Weighted residual factors for all reflections included in the refinement | 0.1261 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.094 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7229173.html
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Users of the data should acknowledge the original authors of the
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