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Information card for entry 2234685
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Jmol._Canvas2D (Jmol) "jmolApplet0"[x]
Coordinates | 2234685.cif |
---|---|
Structure factors | 2234685.hkl |
Original IUCr paper | HTML |
Chemical name | <i>catena</i>-Poly[[[diaquanickel(II)]-μ-pyrazine-2-carboxylato-silver(I)-\ μ-pyrazine-2-carboxylato] nitrate dihydrate] |
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Formula | C10 H14 Ag N5 Ni O11 |
Calculated formula | C10 H14 Ag N5 Ni O11 |
SMILES | [Ag][n]1cc[n]2[Ni]3([OH2])([OH2])(OC(=O)c2c1)OC(=O)c1[n]3cc[n](c1)[Ag][n]1cc[n]2[Ni]3(OC(=O)c2c1)(OC(=O)c1[n]3ccnc1)([OH2])[OH2].O=N(=O)[O-].O=N(=O)[O-].O.O.O.O |
Title of publication | <i>catena</i>-Poly[[[diaquanickel(II)]-μ-pyrazine-2-carboxylato-silver(I)-μ-pyrazine-2-carboxylato] nitrate dihydrate] |
Authors of publication | Yang, Min; Chai, Li-Yuan; Yi, Xiao-Yi |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2012 |
Journal volume | 68 |
Journal issue | 5 |
Pages of publication | m689 |
a | 5.1997 ± 0.001 Å |
b | 27.188 ± 0.005 Å |
c | 6.4347 ± 0.0013 Å |
α | 90° |
β | 111.24 ± 0.03° |
γ | 90° |
Cell volume | 847.9 ± 0.3 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
Space group number | 11 |
Hermann-Mauguin space group symbol | P 1 21/m 1 |
Hall space group symbol | -P 2yb |
Residual factor for all reflections | 0.0947 |
Residual factor for significantly intense reflections | 0.0699 |
Weighted residual factors for significantly intense reflections | 0.2245 |
Weighted residual factors for all reflections included in the refinement | 0.2445 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.009 |
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/2234685.html
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Users of the data should acknowledge the original authors of the
structural data.