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Information card for entry 7011834
Preview
| Coordinates | 7011834.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | H34 K10 O95 P2 Ti4 W20 |
|---|---|
| Calculated formula | K5.6 O92.6 P2 Ti4 W20 |
| Title of publication | Synthesis and pH-variable ultracentrifugation molecular weight measurements of the dimeric, Ti–O–Ti bridged anhydride form of a novel di-Ti^IV^-1,2-substituted α-Keggin polyoxotungstate. Molecular structure of the [(α-1,2-PW~10~Ti~2~O~39~)~2~]^10-^ polyoxoanion |
| Authors of publication | Nomiya, Kenji; Takahashi, Mizuto; Widegren, Jason A.; Aizawa, Takao; Sakai, Yoshitaka; Kasuga, Noriko C. |
| Journal of publication | Journal of the Chemical Society, Dalton Transactions |
| Year of publication | 2002 |
| Journal issue | 19 |
| Pages of publication | 3679 - 3685 |
| a | 19.052 ± 0.002 Å |
| b | 21.021 ± 0.002 Å |
| c | 12.7775 ± 0.0017 Å |
| α | 103.896 ± 0.01° |
| β | 98.175 ± 0.011° |
| γ | 77.22 ± 0.009° |
| Cell volume | 4823 ± 1 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 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 | 0.2125 |
| Residual factor for significantly intense reflections | 0.1092 |
| Weighted residual factors for significantly intense reflections | 0.2694 |
| Weighted residual factors for all reflections included in the refinement | 0.3222 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.061 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 275157 (current) | 2022-05-07 | cif/7/01/18/ Replaced the '¥' sequences with backslash symbols ('\') in multiple data values in entry 7011834. |
7011834.cif |
| 275125 | 2022-05-06 | cif/7/01/18/ Updated bibliographic information in entry 7011834. |
7011834.cif |
| 179822 | 2016-03-25 | cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/18. |
7011834.cif |
| 129439 | 2015-01-07 | cod/ (robertas@burundukas) Correcting values of _exptl_crystal_density_meas and _exptl_crystal_density_method data items: codsql "select codid from validation where message like '%\\'_exptl_crystal_density_meas\\' value \"not measured\" is %'" -NB \ | codid2file \ | xargs perl -i -pe "s/_exptl_crystal_density_meas\\s+'not +measured'/_exptl_crystal_density_meas ?/i; \ s/_exptl_crystal_density_method\\s+('not +measured'|\\?|none)/_exptl_crystal_density_method ./i" |
7011834.cif |
| 120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7011834.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7011834.cif |
| 7477 | 2011-01-18 | cif/7/ Updating (redepositing) the rest of the series-7 files that had non-ASCII symbols in them. Hopefully these are the last instances of non-ASCII text creeped into COD (the new cif-tools should cnvert non-ASCII symbols into XML entities or flag them as errors). |
7011834.cif |
| 3896 | 2010-12-08 | cif/7/ Adding CIFs with data from Dalton-Trans-2004-2000/. |
7011834.cif |
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Users of the data should acknowledge the original authors of the
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