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Information card for entry 8102586
Preview
| Coordinates | 8102586.cif |
|---|
| Chemical name | [[(2-(2-chloro-6-fluorophenyl)-1H-imidazo[4,5-f][1,10]phenanthroline- <i>κ</i>^2^<i>N</i>,<i>N</i>')lead(II)]-μ~2~-naphthalene-1,4-dicarboxylato], [Pb(C~19~H~10~N~4~FCl)(C~12~H~6~O~4~)]^.^0.25H~2~O |
|---|---|
| Formula | C50 H26.5 Cl2 F2 N8 O4.25 Pb |
| Calculated formula | C50 H26.5 Cl2 F2 N8 O4.25 Pb |
| Title of publication | Crystal structure of [bis(2-(2-chloro-6-fluorophenyl)-1H-imidazo[4,5-f][1,10]phenanthroline-k2N,N')lead(II)]-(m2-naphthalene-1,4-dicarboxylato) hydrate, Pb(C19H10N4FCl)2(C12H6O4) · 0.25H2O |
| Authors of publication | Qing-Wei Wang; Bing-Yang Li; Ya-Ming Sun; Wan-Qiu Yu |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2009 |
| Journal volume | 224 |
| Journal issue | 4 |
| Pages of publication | 699 |
| a | 12.091 ± 0.005 Å |
| b | 19.444 ± 0.005 Å |
| c | 18.645 ± 0.005 Å |
| α | 90 ± 0.005° |
| β | 101.703 ± 0.005° |
| γ | 90 ± 0.005° |
| Cell volume | 4292 ± 2 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 7 |
| 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 | 0.0929 |
| Residual factor for significantly intense reflections | 0.0366 |
| Weighted residual factors for significantly intense reflections | 0.0838 |
| Weighted residual factors for all reflections included in the refinement | 0.0928 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.84 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 200426 (current) | 2017-09-11 | cif/8/10/ Marking attached hydrogen atoms in entries 8101584, 8102015, 8102265, 8102379, 8102583, 8102586, 8103218, 8103976, 8104172. |
8102586.cif |
| 200423 | 2017-09-11 | cif/8/10/25/ Marking atoms 'O2' and 'O2'' as belonging to disorder groups '1' and '2' in entry 8102586 after consulting the original publication. |
8102586.cif |
| 176466 | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 8. |
8102586.cif |
| 35911 | 2012-02-28 | cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree. |
8102586.cif |
| 13325 | 2011-03-06 | ../uploads/cif-deposit/cod/cif Adding structures of 8102586 via cif-deposit CGI script. |
8102586.cif |
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