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Information card for entry 4110200
Preview
| Coordinates | 4110200.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C73 H58.67 B1.33 Cl7.33 F5.33 N4 O4 P2.67 Rh1.33 S2.67 Zn1.33 |
|---|---|
| Calculated formula | C73 H58.6667 B1.33333 Cl7.33333 F5.33333 N4 O4 P2.66667 Rh1.33333 S2.66667 Zn1.33333 |
| Title of publication | Allosteric Regulation of Phosphate Diester Transesterification Based upon a Dinuclear Zinc Catalyst Assembled via the Weak-Link Approach |
| Authors of publication | Hyo Jae Yoon; Jungseok Heo; Chad A. Mirkin |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2007 |
| Journal volume | 129 |
| Pages of publication | 14182 - 14183 |
| a | 29.635 ± 0.004 Å |
| b | 20.97 ± 0.003 Å |
| c | 19.375 ± 0.003 Å |
| α | 90° |
| β | 95.606 ± 0.003° |
| γ | 90° |
| Cell volume | 11983 ± 3 Å3 |
| Cell temperature | 153 ± 2 K |
| Ambient diffraction temperature | 153 ± 2 K |
| Number of distinct elements | 11 |
| 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 | 0.4146 |
| Residual factor for significantly intense reflections | 0.1367 |
| Weighted residual factors for significantly intense reflections | 0.3066 |
| Weighted residual factors for all reflections included in the refinement | 0.4143 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.913 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178873 (current) | 2016-03-22 | cif/4/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/11/02. |
4110200.cif |
| 120077 | 2014-07-12 | Adding DOIs to range 4/11 structures. | 4110200.cif |
| 59221 | 2012-06-05 | cif/4/ Setting up the svn:keywords property on the recently moved CIFs, so that the file checked out under English locales do not contain high-bit-set characters. |
4110200.cif |
| 59116 | 2012-06-03 | smi/7 Adding SMILES for metal carbonyls. cif/4 Moving files wrongly appearing as 4/4xxyyzz.cif as 4/xx/yy/4xxyyzz.cif |
4110200.cif |
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Users of the data should acknowledge the original authors of the
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