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Information card for entry 2239221
Preview
Coordinates | 2239221.cif |
---|---|
Structure factors | 2239221.hkl |
Original IUCr paper | HTML |
Chemical name | Bis(μ-nitrato-κ^2^<i>O</i>:<i>O</i>)bis{[1,2-bis(diisopropylphosphanyl)-1,2-dicarba-<i>closo</i>-dodecaborane-κ^2^<i>P</i>,<i>P</i>']silver(I)} dichloromethane disolvate |
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Formula | C30 H80 Ag2 B20 Cl4 N2 O6 P4 |
Calculated formula | C30 H80 Ag2 B20 Cl4 N2 O6 P4 |
SMILES | [BH]1234[BH]567[BH]89%10[BH]%11%12%13[BH]%14%15%16[BH]%178%11[BH]87%10[BH]736[BH]4%15([C]1%12%14[P](C(C)C)([Ag]1([O](N(=O)=O)[Ag]3([O]1N(=O)=O)[P]([C]146[BH]%10%11%12[BH]%14%15%18[BH]%19%20%10[BH]%10%21%22[BH]%234([BH]4%246[BH]1%11%14[BH]1%18%24[BH]%15%19%10[BH]%21%2341)[C]%12%20%22[P]3(C(C)C)C(C)C)(C(C)C)C(C)C)[P]([C]259%13)(C(C)C)C(C)C)C(C)C)[BH]%16%1787.C(Cl)Cl.C(Cl)Cl |
Title of publication | Bis(μ-nitrato-κ^2^<i>O</i>:<i>O</i>)bis{[1,2-bis(diisopropylphosphanyl)-1,2-dicarba-<i>closo</i>-dodecaborane-κ^2^<i>P</i>,<i>P</i>']silver(I)} dichloromethane disolvate |
Authors of publication | Yang, Liguo |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2014 |
Journal volume | 70 |
Journal issue | 4 |
Pages of publication | m141 |
a | 13.9256 ± 0.0015 Å |
b | 10.3003 ± 0.001 Å |
c | 21.8075 ± 0.0019 Å |
α | 90° |
β | 107.734 ± 0.002° |
γ | 90° |
Cell volume | 2979.4 ± 0.5 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 2 K |
Number of distinct elements | 8 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0571 |
Residual factor for significantly intense reflections | 0.0341 |
Weighted residual factors for significantly intense reflections | 0.0754 |
Weighted residual factors for all reflections included in the refinement | 0.0911 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.048 |
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/2239221.html
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