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Information card for entry 8102401
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| Coordinates | 8102401.cif |
|---|
| Chemical name | rac-[1,2-ethylene-bis(η^5^-4,5,6,7-tetrahydroindenyl)] -1-hafna-4,5-bis(trimethylsilyl)furan-3-one -tris(pentafluorophenyl)borane- Adduct, C~47~H~42~BF~15~HfO~2~Si~2~ |
|---|---|
| Formula | C47 H42 B F15 Hf O2 Si2 |
| Calculated formula | C47 H42 B F15 Hf O2 Si2 |
| Title of publication | Crystal structure of rac-[1,2-ethylene-bis(η5-4,5,6,7-tetrahydroindenyl)]-1-hafna-4,5-bis(trimethyl- silyl)furan-3-one-tris(pentafluorophenyl)borane, (C20H24)Hf(Me3SiC2SiMe3CO2)B(C6F5)3 |
| Authors of publication | Torsten Beweries; Vladimir V. Burlakov; Uwe Rosenthal; Anke Spannenberg |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2009 |
| Journal volume | 224 |
| Journal issue | 1 |
| Pages of publication | 95 |
| a | 15.7496 ± 0.0004 Å |
| b | 20.4074 ± 0.0005 Å |
| c | 16.3115 ± 0.0005 Å |
| α | 90° |
| β | 96.313 ± 0.002° |
| γ | 90° |
| Cell volume | 5210.9 ± 0.2 Å3 |
| Cell temperature | 200 ± 2 K |
| Ambient diffraction temperature | 200 ± 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 | 0.0581 |
| Residual factor for significantly intense reflections | 0.0271 |
| Weighted residual factors for significantly intense reflections | 0.0456 |
| Weighted residual factors for all reflections included in the refinement | 0.0492 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.776 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| 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. |
8102401.cif |
| 35911 | 2012-02-28 | cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree. |
8102401.cif |
| 13140 | 2011-03-06 | ../uploads/cif-deposit/cod/cif Adding structures of 8102401 via cif-deposit CGI script. |
8102401.cif |
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Users of the data should acknowledge the original authors of the
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