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Information card for entry 2017849
Preview
Coordinates | 2017849.cif |
---|---|
Structure factors | 2017849.hkl |
Original IUCr paper | HTML |
Common name | Λ(+)~578~-bis(en)[(S-Asp(OEt)O)]cobalt(III) perchlorate monohydrate |
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Chemical name | Λ(+)~578~-bis(ethane-1,2-diamine)[β-ethyl (<i>S</i>)-aspartato- κ^2^<i>N</i>,<i>O</i>^1^]cobalt(III) bis(perchlorate) monohydrate |
Formula | C10 H28 Cl2 Co N5 O13 |
Calculated formula | C10 H28 Cl2 Co N5 O13 |
Title of publication | Diastereoisomeric β-ethyl aspartate‒cobalt(III) complexes: Λ(+)~578~- and Δ({-})~578~-bis(ethane-1,2-diamine)[β-ethyl (<i>S</i>)-aspartato]cobalt(III) bis(perchlorate) monohydrate |
Authors of publication | Hammershøi, Anders; Schau-Magnussen, Magnus; Bendix, Jesper; Mølgaard, Anne |
Journal of publication | Acta Crystallographica Section C |
Year of publication | 2010 |
Journal volume | 66 |
Journal issue | 11 |
Pages of publication | m319 - m322 |
a | 11.6507 ± 0.0004 Å |
b | 8.76 ± 0.0005 Å |
c | 11.7169 ± 0.0006 Å |
α | 90° |
β | 113.572 ± 0.004° |
γ | 90° |
Cell volume | 1096.05 ± 0.1 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 2 K |
Number of distinct elements | 6 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0495 |
Residual factor for significantly intense reflections | 0.0445 |
Weighted residual factors for significantly intense reflections | 0.1301 |
Weighted residual factors for all reflections included in the refinement | 0.1386 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.054 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | Yes |
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