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Information card for entry 7005636
Preview
Coordinates | 7005636.cif |
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Original paper (by DOI) | HTML |
Formula | C27 H21 I3 N18 Zn2 |
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Calculated formula | C27 H21 I3 N18 Zn2 |
SMILES | [Zn]1234N(C=[N]5[Zn]6([n]7cccnc57)([n]5cccnc5N6C=[N]2c2ncccn2)N(c2ncccn2)C=[N]3c2nccc[n]42)c2nccc[n]12.[I-](I)I |
Title of publication | Crystal structures and solution behaviors of dinuclear d(10)-metal complexes containing anions of N,N'-bis(pyrimidine-2-yl)formamidine. |
Authors of publication | Chan, Zhi-Kai; Chen, Tsun-Ren; Chen, Jhy-Der; Wang, Ju-Chun; Liu, C. W. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2007 |
Journal issue | 31 |
Pages of publication | 3450 - 3458 |
a | 30.688 ± 0.002 Å |
b | 11.6319 ± 0.0007 Å |
c | 25.9213 ± 0.0017 Å |
α | 90° |
β | 102.344 ± 0.001° |
γ | 90° |
Cell volume | 9039 ± 1 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
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 | 0.0571 |
Residual factor for significantly intense reflections | 0.0303 |
Weighted residual factors for significantly intense reflections | 0.0542 |
Weighted residual factors for all reflections included in the refinement | 0.0564 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.031 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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