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Information card for entry 7008814
Preview
Coordinates | 7008814.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C88 H78 Cl4 Cu4 O2 P6 S6 |
---|---|
Calculated formula | C88 H78 Cl4 Cu4 O2 P6 S6 |
Title of publication | A strategy for the build-up of transition-metal complexes containing tripodal [ArPOS2]2- and [ArPS3]2- ligands (Ar = 4-anisyl). |
Authors of publication | Shi, Weifeng; Shafaei-Fallah, Maryam; Anson, Christopher E.; Rothenberger, Alexander |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2005 |
Journal issue | 24 |
Pages of publication | 3909 - 3912 |
a | 12.96 ± 0.003 Å |
b | 22.853 ± 0.005 Å |
c | 15.976 ± 0.003 Å |
α | 90° |
β | 113.02 ± 0.03° |
γ | 90° |
Cell volume | 4354.9 ± 1.9 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 7 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0613 |
Residual factor for significantly intense reflections | 0.0442 |
Weighted residual factors for significantly intense reflections | 0.1271 |
Weighted residual factors for all reflections included in the refinement | 0.1556 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.134 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
189767 (current) | 2017-01-03 | cif/7/00/ (antanas@echidna.ibt.lt) Marking attached hydrogen atoms in entries 7008814, 7008816. |
7008814.cif |
179792 | 2016-03-25 | cif/7/00/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/00/88. |
7008814.cif |
120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7008814.cif |
35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7008814.cif |
1504 | 2010-09-08 | cif/7/ Adding data extracted from RSC 2005 and 2006 year publications. |
7008814.cif |
All data in the COD and the database itself are dedicated to the
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Users of the data should acknowledge the original authors of the
structural data.