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Information card for entry 4503285
Preview
Coordinates | 4503285.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | CoEnOx-26NDS-H2O |
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Formula | C11 H23 Co N4 O9 S |
Calculated formula | C11 H23 Co N4 O9 S |
Title of publication | A Series of Guest-Defined Metal-Complex/Disulfonate Frameworks of Hydrogen-Bonded [Co(en)2(ox)]+and 2,6-Naphtalenedisulfonate |
Authors of publication | Wang, Xin-Yi; Sevov, Slavi C. |
Journal of publication | Crystal Growth & Design |
Year of publication | 2008 |
Journal volume | 8 |
Journal issue | 4 |
Pages of publication | 1265 |
a | 7.7554 ± 0.0003 Å |
b | 8.4738 ± 0.0003 Å |
c | 13.5889 ± 0.0005 Å |
α | 74.136 ± 0.001° |
β | 87.049 ± 0.001° |
γ | 85.93 ± 0.001° |
Cell volume | 856.37 ± 0.06 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 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 | 0.0355 |
Residual factor for significantly intense reflections | 0.032 |
Weighted residual factors for significantly intense reflections | 0.0842 |
Weighted residual factors for all reflections included in the refinement | 0.0862 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.075 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
179563 (current) | 2016-03-24 | cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/32. |
4503285.cif |
130086 | 2015-01-23 | cod/ (robertas@burundukas) The 'cif_fix_values' program was applied to CIFs that have generated the validation messages containing tag '_exptl_crystal_density_meas'. 16946 CIFs had a values that were perceived as 'not measured' and they were changed to '?'. The total of 17089 CIFs was changed. Those that were not corrected by 'cif_fix_values' were reformatted by the parser (e.g. a doi tag was moved to another place). The processing command was: mysql -u cod_reader -h www.crystallography.net cod -e \ 'select distinct codid from validation \ where message like \ "%tag%_exptl_crystal_density_meas'\''%"' -NB \ | xargs -i sh -c 'cif_fix_values {} \ | cif_filter --add-cif-header {} \ | sponge {}' |
4503285.cif |
120110 | 2014-07-12 | Adding DOIs to range 4/50 structures. | 4503285.cif |
41460 | 2012-03-13 | ../uploads/cif-deposit/cod/cif Adding structures of 4503285, 4503286, 4503287, 4503288, 4503289 via cif-deposit CGI script. |
4503285.cif |
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