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Information card for entry 2234265
Preview
Coordinates | 2234265.cif |
---|---|
Structure factors | 2234265.hkl |
Original IUCr paper | HTML |
Chemical name | <i>catena</i>-Poly[(chloridozinc)-μ-5-(1-methyl-1<i>H</i>-benzimidazol- 2-yl-κ<i>N</i>^3^)-1,2,3-triazol-1-ido-κ^2^<i>N</i>^1^:<i>N</i>^3^] |
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Formula | C10 H8 Cl N5 Zn |
Calculated formula | C10 H8 Cl N5 Zn |
SMILES | [Zn]1(Cl)([n]2c(n(c3c2cccc3)C)c2n1nnc2)n1n[n]2[Zn](Cl)[n]3c(n(c4c3cccc4)C)c2c1 |
Title of publication | <i>catena</i>-Poly[(chloridozinc)-μ-5-(1-methyl-1<i>H</i>-benzimidazol-2-yl-κ<i>N</i>^3^)-1,2,3-triazol-1-ido-κ^2^<i>N</i>^1^:<i>N</i>^3^] |
Authors of publication | Sun, Chen-Guang; Song, Ji-Rong |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2012 |
Journal volume | 68 |
Journal issue | 4 |
Pages of publication | m520 |
a | 16.0822 ± 0.0001 Å |
b | 16.0822 ± 0.0001 Å |
c | 9.0114 ± 0.0002 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2330.68 ± 0.06 Å3 |
Cell temperature | 153 ± 2 K |
Ambient diffraction temperature | 153 ± 2 K |
Number of distinct elements | 5 |
Space group number | 86 |
Hermann-Mauguin space group symbol | P 42/n :2 |
Hall space group symbol | -P 4bc |
Residual factor for all reflections | 0.0284 |
Residual factor for significantly intense reflections | 0.0237 |
Weighted residual factors for significantly intense reflections | 0.0579 |
Weighted residual factors for all reflections included in the refinement | 0.0608 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.05 |
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/2234265.html
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