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Information card for entry 4308908
Preview
| Coordinates | 4308908.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C48 H63 F6 Mo3 N P2 Ru S4 |
|---|---|
| Calculated formula | C48 H63 F6 Mo3 N P2 Ru S4 |
| SMILES | [Ru]12([S]3[Mo]45678([S]1[Mo]19%10%11%12([S]2[Mo]23%13%14%15([S]14)[c]1([c]%13([c]%14([c]2([c]1%15C)C)C)C)C)[c]1([c]9([c]%10([c]%11([c]%121C)C)C)C)C)[c]1([c]5([c]6([c]7([c]18C)C)C)C)C)([P](c1ccccc1)(c1ccccc1)c1ccccc1)[NH3].[P](F)(F)(F)(F)(F)[F-] |
| Title of publication | Cleavage of Hydrazine N-N Bonds by RuMo3S4 Cubane-Type Clusters |
| Authors of publication | Izuru Takei; Keita Dohki; Koji Kobayashi; Toshiaki Suzuki; Masanobu Hidai |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2005 |
| Journal volume | 44 |
| Pages of publication | 3768 - 3770 |
| a | 11.135 ± 0.0007 Å |
| b | 23.9955 ± 0.0015 Å |
| c | 19.7074 ± 0.0013 Å |
| α | 90° |
| β | 95.005 ± 0.003° |
| γ | 90° |
| Cell volume | 5245.5 ± 0.6 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 8 |
| 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 | 0.0722 |
| Residual factor for significantly intense reflections | 0.0652 |
| Weighted residual factors for significantly intense reflections | 0.1581 |
| Weighted residual factors for all reflections included in the refinement | 0.1652 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.078 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179127 (current) | 2016-03-23 | cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/89. |
4308908.cif |
| 120081 | 2014-07-12 | Adding DOIs to range 4/30 structures. | 4308908.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4308908.cif |
| 1526 | 2010-09-26 | cif/4/ Adding new CIFs from Inorg. Chem. 2005 deposited via Web deposition site to the COD test database (and transferede to the main COD database after renaming). |
4308908.cif |
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Users of the data should acknowledge the original authors of the
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