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Information card for entry 2009143
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Coordinates | 2009143.cif |
---|---|
Original IUCr paper | HTML |
Chemical name | Diacetato-bis(3-amino-5-phenylpyrazole)zinc(II) |
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Formula | C24 H32 N6 O6 Zn |
Calculated formula | C24 H32 N6 O6 Zn |
SMILES | [Zn](OC(=O)C)(OC(=O)C)(n1[nH]c(cc1N)c1ccccc1)n1[nH]c(cc1N)c1ccccc1.CO.CO |
Title of publication | Transition metal complexes with pyrazole-derived ligands. X. [Zn(CH~3~COO)~2~<i>L</i>~2~]^.^2MeOH (<i>L</i> = 3-amino-5-phenylpyrazole) |
Authors of publication | Jaćimović, Zeljko K.; Tomić, Zoran D.; Bogdanović, Goran A.; Ivegeš, Erika Z.; Leovac, Vukadin M. |
Journal of publication | Acta Crystallographica Section C |
Year of publication | 1999 |
Journal volume | 55 |
Journal issue | 11 |
Pages of publication | 1769 - 1771 |
a | 9.377 ± 0.002 Å |
b | 9.94 ± 0.001 Å |
c | 15.344 ± 0.002 Å |
α | 93.06 ± 0.02° |
β | 98.17 ± 0.03° |
γ | 98.23 ± 0.02° |
Cell volume | 1397.1 ± 0.4 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0845 |
Residual factor for significantly intense reflections | 0.0506 |
Weighted residual factors for all reflections | 0.1643 |
Weighted residual factors for all reflections included in the refinement | 0.1459 |
Goodness-of-fit parameter for all reflections | 1.027 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.131 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2009143.html
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Users of the data should acknowledge the original authors of the
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