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Information card for entry 7212235
Preview
Coordinates | 7212235.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C49.8 H59.2 Cu2 K N5 O8.8 S |
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Calculated formula | C49.8 H59.2 Cu2 K N5 O8.8 S |
Title of publication | Host‒guest chemistry of a chiral Schiff base copper(ii) complex: can chiral information be transferred to the guest cation? |
Authors of publication | Constable, Edwin C.; Zhang, Guoqi; Housecroft, Catherine E.; Neuburger, Markus; Zampese, Jennifer A. |
Journal of publication | CrystEngComm |
Year of publication | 2010 |
Journal volume | 12 |
Journal issue | 6 |
Pages of publication | 1764 |
a | 9.83 ± 0.002 Å |
b | 11.531 ± 0.002 Å |
c | 12.209 ± 0.002 Å |
α | 105.53 ± 0.03° |
β | 103.18 ± 0.03° |
γ | 105.74 ± 0.03° |
Cell volume | 1214.1 ± 0.6 Å3 |
Cell temperature | 173 K |
Ambient diffraction temperature | 173 K |
Number of distinct elements | 7 |
Space group number | 1 |
Hermann-Mauguin space group symbol | P 1 |
Hall space group symbol | P 1 |
Residual factor for all reflections | 0.0466 |
Residual factor for significantly intense reflections | 0.042 |
Weighted residual factors for all reflections | 0.0543 |
Weighted residual factors for significantly intense reflections | 0.0474 |
Weighted residual factors for all reflections included in the refinement | 0.0469 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.0761 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7212235.html
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