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Information card for entry 4081428
Preview
Coordinates | 4081428.cif |
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Original paper (by DOI) | HTML |
Formula | C50 H30 Ag6 Cl4 F6 N6 O6 S3 |
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Calculated formula | C50 H30 Ag6 Cl4 F6 N6 O6 S3 |
Title of publication | Silver‒Organic Frameworks Containing Ethynediide or Ethynide with Ancillary Oligo-α-sulfanylpyrazinyl and Dimethylsulfoxide Ligands |
Authors of publication | Wen, Li-Li; Wang, Han; Wan, Chong-Qing; Mak, Thomas C. W. |
Journal of publication | Organometallics |
Year of publication | 2013 |
Journal volume | 32 |
Journal issue | 18 |
Pages of publication | 5144 |
a | 12.6136 ± 0.0015 Å |
b | 15.7657 ± 0.0019 Å |
c | 15.9415 ± 0.0019 Å |
α | 110.662 ± 0.002° |
β | 91.021 ± 0.002° |
γ | 103.973 ± 0.002° |
Cell volume | 2859.9 ± 0.6 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 8 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0811 |
Residual factor for significantly intense reflections | 0.0733 |
Weighted residual factors for significantly intense reflections | 0.2078 |
Weighted residual factors for all reflections included in the refinement | 0.2175 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.064 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
178703 (current) | 2016-03-21 | cif/4/08/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/08/14. |
4081428.cif |
89232 | 2013-10-09 | cif/ Adding structures of 4081424, 4081425, 4081426, 4081427, 4081428 via cif-deposit CGI script. |
4081428.cif |
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Users of the data should acknowledge the original authors of the
structural data.