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Information card for entry 7027748
Preview
Coordinates | 7027748.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C27 H32 Cd Cl2 N6 O10 |
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Calculated formula | C27 H32 Cd Cl2 N6 O10 |
Title of publication | Zinc and cadmium complexes of an 18-membered N4O2 oxaaza-Schiff base macrocycle and the corresponding reduced form † |
Authors of publication | Adams, Harry; Bastida, Rufina; Fenton, David E.; Macías, Alejandro; Spey, Sharon E.; Valencia, Laura |
Journal of publication | Journal of the Chemical Society, Dalton Transactions |
Year of publication | 1999 |
Journal issue | 23 |
Pages of publication | 4131 |
a | 8.726 ± 0.0005 Å |
b | 10.5384 ± 0.0006 Å |
c | 34.657 ± 0.002 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3187 ± 0.3 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.043 |
Residual factor for significantly intense reflections | 0.0349 |
Weighted residual factors for significantly intense reflections | 0.0731 |
Weighted residual factors for all reflections included in the refinement | 0.0826 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.994 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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