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Information card for entry 4312554
Preview
Coordinates | 4312554.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C44 H36 Ag6 N8 Na4 O28 S6 |
---|---|
Calculated formula | C44 H32 Ag6 N8 Na4 O28 S6 |
SMILES | c12[n](cccc2C(=O)[O-])[Ag]234[Ag]567[n]8cccc(c8[S]3[Ag]387[Ag]79([S]%10[Ag]%112([n]2cccc(c2[S]4[Ag]9%11([n]2c%10c(C(=O)[O-])ccc2)[S]8c2c(C(=O)[O-])ccc[n]72)C(=O)[O-])[S]15)[S]6c1[n]3cccc1C(=O)[O-])C(=O)[O-].[NH3+]C(CO)(CO)C(=O)[O-].O.[Na+].O.[Na+].O.[O-]C(=O)C(CO)(CO)[NH3+].O.O.[Na+].O.[Na+].O.O |
Title of publication | Synthesis and Structure of a Water-Soluble Hexanuclear Silver(I) Nicotinate Cluster Comprised of a "Cyclohexane-Chair"-Type of Framework, Showing Effective Antibacterial and Antifungal Activities: Use of "Sparse Matrix" Techniques for Growing Crystals of Water-Soluble Inorganic Complexes |
Authors of publication | Irina Tsyba; Becky Bun-kit Mui; Robert Bau; Ryusuke Noguchi; Kenji Nomiya |
Journal of publication | Inorganic Chemistry |
Year of publication | 2003 |
Journal volume | 42 |
Pages of publication | 8028 - 8032 |
a | 12.1119 ± 0.0015 Å |
b | 12.5555 ± 0.0015 Å |
c | 12.6565 ± 0.0015 Å |
α | 62.874 ± 0.002° |
β | 70.151 ± 0.002° |
γ | 84.075 ± 0.002° |
Cell volume | 1608.2 ± 0.3 Å3 |
Cell temperature | 358 ± 2 K |
Ambient diffraction temperature | 358 ± 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 | 0.0347 |
Residual factor for significantly intense reflections | 0.0326 |
Weighted residual factors for significantly intense reflections | 0.0767 |
Weighted residual factors for all reflections included in the refinement | 0.0779 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.142 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4312554.html
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