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Information card for entry 2230309
Preview
Coordinates | 2230309.cif |
---|---|
Structure factors | 2230309.hkl |
Original IUCr paper | HTML |
Chemical name | Chloridobis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II) tetrakis(nitrato-κ^2^<i>O</i>,<i>O</i>')(1,10-phenanthroline- κ^2^<i>N</i>,<i>N</i>')terbate(III) |
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Formula | C36 H24 Cl Cu N10 O12 Tb |
Calculated formula | C36 H24 Cl Cu N10 O12 Tb |
SMILES | [Cu]12(Cl)([n]3cccc4ccc5ccc[n]1c5c34)[n]1cccc3ccc4ccc[n]2c4c13.[Tb]12345([O]=N(=O)O1)(ON(=[O]2)=O)(ON(=[O]3)=O)(ON(=[O]4)=O)[n]1cccc2ccc3ccc[n]5c3c12 |
Title of publication | Chloridobis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II) tetrakis(nitrato-κ^2^<i>O</i>,<i>O</i>')(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')terbate(III) |
Authors of publication | Gao, Guo-Ran; Man, Hong-Xue; Xiao, Zhi-Chang; Deng, Yu-Heng |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2011 |
Journal volume | 67 |
Journal issue | 6 |
Pages of publication | m787 - m788 |
a | 10.1556 ± 0.0001 Å |
b | 13.4799 ± 0.0002 Å |
c | 14.771 ± 0.0002 Å |
α | 81.103 ± 0.001° |
β | 75.631 ± 0.001° |
γ | 84.465 ± 0.001° |
Cell volume | 1931.71 ± 0.04 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 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 | 0.0568 |
Residual factor for significantly intense reflections | 0.0353 |
Weighted residual factors for significantly intense reflections | 0.07 |
Weighted residual factors for all reflections included in the refinement | 0.0779 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.032 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2230309.html
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