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Information card for entry 8101831
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Coordinates | 8101831.cif |
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Formula | C52 H56 Au2 N2 O6 P2 S2 |
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Calculated formula | C52 H56 Au2 N2 O6 P2 S2 |
Title of publication | Crystal structure of bis(μ-diphenylphosphino)butane-P,P'-bis [(N-(4-ethylcarboxyphenyl)-O-ethylthiocarbamato)gold(I)], [(CH~2~) ~4~(C~6~H~5~)~2~P)~2~][Au(SCNC~6~H~4~CO~2~C~2~H~5~)]~2~ |
Authors of publication | S. Y. Ho; E. R. T. Tiekink |
Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
Year of publication | 2005 |
Journal volume | 220 |
Journal issue | 3 |
Pages of publication | 475 - 476 |
a | 10.5006 ± 0.0016 Å |
b | 10.1454 ± 0.0016 Å |
c | 24.085 ± 0.004 Å |
α | 90° |
β | 92.546 ± 0.004° |
γ | 90° |
Cell volume | 2563.3 ± 0.7 Å3 |
Cell temperature | 223 ± 2 K |
Ambient diffraction temperature | 223 ± 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 | 0.07 |
Residual factor for significantly intense reflections | 0.045 |
Weighted residual factors for significantly intense reflections | 0.117 |
Weighted residual factors for all reflections included in the refinement | 0.146 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.08 |
Diffraction radiation wavelength | 0.71069 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
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. |
8101831.cif |
108037 | 2014-03-26 | cif/8/ (antanas@lokys.ibt.lt) Changing '_refine_ls_shift/su_max' tag to '_refine_ls_shift/su_max_lt' and removing less than symbol ('>') from the value. |
8101831.cif |
107931 | 2014-03-24 | cif/8/ (antanas@lokys.ibt.lt) Adding and updating bibliographic information: volume, authors, issue, first page, last page. |
8101831.cif |
35911 | 2012-02-28 | cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree. |
8101831.cif |
12570 | 2011-03-05 | ../uploads/cif-deposit/cod/cif Adding structures of 8101831 via cif-deposit CGI script. |
8101831.cif |
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Users of the data should acknowledge the original authors of the
structural data.