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Information card for entry 2008836
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Coordinates | 2008836.cif |
---|---|
Original IUCr paper | HTML |
Chemical name | 1-methylhydroxy-(cyclopentadienyl (cyclopentadienyl)iron)-1,2-dicarba-closo-dodecaborane |
---|---|
Formula | C13 H22 B10 Fe O |
Calculated formula | C13.005 H22 B10 Fe O |
Title of publication | 1-[Ferrocenyl(hydroxy)methyl]-1,2-dicarba-<i>closo</i>-dodecaborane |
Authors of publication | Crundwell, Guy; Arellanes, Chuauthemoc; Gomez, Frank; Kantardjieff, Katherine |
Journal of publication | Acta Crystallographica Section C |
Year of publication | 1999 |
Journal volume | 55 |
Journal issue | 8 |
Pages of publication | IUC9900087 |
a | 10.5481 ± 0.0005 Å |
b | 8.9867 ± 0.0004 Å |
c | 18.5961 ± 0.0009 Å |
α | 90° |
β | 94.426 ± 0.001° |
γ | 90° |
Cell volume | 1757.52 ± 0.14 Å3 |
Cell temperature | 213 ± 2 K |
Ambient diffraction temperature | 213 ± 2 K |
Number of distinct elements | 5 |
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 | 0.057 |
Residual factor for significantly intense reflections | 0.041 |
Weighted residual factors for all reflections included in the refinement | 0.093 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.02 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/2008836.html
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