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Information card for entry 7206672
Preview
| Coordinates | 7206672.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | catena-((mu2-biphenyl-4,4'-dicarboxylate)-(bis(mu3-1,3,5- triaza-7-phosphaadamantane)) -disilver(i)-dihydrate) |
|---|---|
| Chemical name | catena-((μ2-biphenyl-4,4'-dicarboxylate)- (bis(μ3-1,3,5-triaza-7-phosphaadamantane)) -disilver(I)-dihydrate) |
| Formula | C13 H20 Ag N3 O4 P |
| Calculated formula | C13 H20 Ag N3 O4 P |
| Title of publication | Crystal engineering with 1,3,5-triaza-7-phosphaadamantane (PTA): first PTA-driven 3D metal‒organic frameworks |
| Authors of publication | Kirillov, Alexander M.; Wieczorek, Sabina W.; Guedes da Silva, M. Fátima C.; Sokolnicki, Jerzy; Smoleński, Piotr; Pombeiro, Armando J. L. |
| Journal of publication | CrystEngComm |
| Year of publication | 2011 |
| Journal volume | 13 |
| Journal issue | 21 |
| Pages of publication | 6329 |
| a | 6.4294 ± 0.0008 Å |
| b | 20.626 ± 0.003 Å |
| c | 11.6196 ± 0.0011 Å |
| α | 90° |
| β | 90.708 ± 0.004° |
| γ | 90° |
| Cell volume | 1540.8 ± 0.3 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 6 |
| 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 | 0.0891 |
| Residual factor for significantly intense reflections | 0.0461 |
| Weighted residual factors for significantly intense reflections | 0.0752 |
| Weighted residual factors for all reflections included in the refinement | 0.0867 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.97 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180397 (current) | 2016-03-26 | cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/66. |
7206672.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7206672.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7206672.cif |
| 29979 | 2011-11-09 | ../uploads/cif-deposit/cod/cif Adding structures of 7206672, 7206673 via cif-deposit CGI script. |
7206672.cif |
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Users of the data should acknowledge the original authors of the
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