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Information card for entry 7238280
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Coordinates | 7238280.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | N,N,N',N'-tetraacetyl ethylenediamine |
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Formula | C10 H16 N2 O4 |
Calculated formula | C10 H16 N2 O4 |
Title of publication | Effective double-ended chelating agents: crystal structures of N,N,N′,N′-tetraacetyl diamino derivatives and their chelates |
Authors of publication | Aakeröy, Christer B.; Desper, John; Haque, Naheed; Hussain, Izhar |
Journal of publication | CrystEngComm |
Year of publication | 2010 |
Journal volume | 12 |
Journal issue | 10 |
Pages of publication | 3218 |
a | 5.915 ± 0.0004 Å |
b | 10.1956 ± 0.0007 Å |
c | 9.1495 ± 0.0007 Å |
α | 90° |
β | 96.388 ± 0.005° |
γ | 90° |
Cell volume | 548.35 ± 0.07 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 4 |
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 | 0.0652 |
Residual factor for significantly intense reflections | 0.061 |
Weighted residual factors for significantly intense reflections | 0.1556 |
Weighted residual factors for all reflections included in the refinement | 0.1608 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.104 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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