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Information card for entry 8102069
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| Coordinates | 8102069.cif |
|---|
| Chemical name | bis(1,10-phenanthroline-N,N')bis(2-bromo-benzoato)lead(II) hydrate (1:2.5) |
|---|---|
| Formula | C76 H58 Br4 N8 O13 Pb2 |
| Calculated formula | C76 H58 Br4 N8 O13 Pb2 |
| Title of publication | Crystal structure of bis(1,10-phenanthroline-N,N')-bis(2-bromobenzoato) lead(II) hydrate (1:2.5), [Pb(C~7~H~4~O~2~Br)~2~(C~12~H~8~N~2~)~2~] · 2.5H~2~O |
| Authors of publication | Zhang, B.-S. |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2006 |
| Journal volume | 221 |
| Journal issue | 4 |
| Pages of publication | 511 - 513 |
| a | 11.6717 ± 0.0002 Å |
| b | 12.5543 ± 0.0002 Å |
| c | 13.6995 ± 0.0003 Å |
| α | 95.132 ± 0.001° |
| β | 112.69 ± 0.001° |
| γ | 103.895 ± 0.001° |
| Cell volume | 1760.28 ± 0.06 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0692 |
| Residual factor for significantly intense reflections | 0.0412 |
| Weighted residual factors for significantly intense reflections | 0.1056 |
| Weighted residual factors for all reflections included in the refinement | 0.1152 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.05 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176728 (current) | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 8. |
8102069.cif |
| 108108 | 2014-03-27 | cif/8/ (antanas@lokys.ibt.lt) Removing some extra characters introduced while converting CIF's from one encoding into the other. |
8102069.cif |
| 108008 | 2014-03-26 | cif/8/ (antanas@lokys.ibt.lt) Adding and updating bibliographic information: volume, authors, issue, first page, last page. |
8102069.cif |
| 35911 | 2012-02-28 | cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree. |
8102069.cif |
| 12808 | 2011-03-05 | ../uploads/cif-deposit/cod/cif Adding structures of 8102069 via cif-deposit CGI script. |
8102069.cif |
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