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Information card for entry 7238277
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Coordinates | 7238277.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | N,N,N',N'-tetraacetyl-alpha,alpha'-diamino-p-xylene |
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Formula | C16 H20 N2 O4 |
Calculated formula | C16 H20 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 | 12.5627 ± 0.0005 Å |
b | 13.5463 ± 0.0004 Å |
c | 9.3888 ± 0.0003 Å |
α | 90° |
β | 95.444 ± 0.002° |
γ | 90° |
Cell volume | 1590.56 ± 0.09 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 4 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0529 |
Residual factor for significantly intense reflections | 0.0461 |
Weighted residual factors for significantly intense reflections | 0.1151 |
Weighted residual factors for all reflections included in the refinement | 0.119 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.126 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7238277.html
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