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Information card for entry 4507431
Preview
Coordinates | 4507431.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C192 H144 Cu4 N28 O12 |
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Calculated formula | C192 H144 Cu4 N28 O12 |
Title of publication | Nanosized Coordination Cages Incorporating Multiple Cu(I) Reactive Sites: Host‒Guest Modulated Catalytic Activity |
Authors of publication | He, Qi-Ting; Li, Xiang-Ping; Chen, Lian-Fen; Zhang, Li; Wang, Wei; Su, Cheng-Yong |
Journal of publication | ACS Catalysis |
Year of publication | 2013 |
Journal volume | 3 |
Journal issue | 1 |
Pages of publication | 1 |
a | 26.531 ± 0.0004 Å |
b | 29.2825 ± 0.001 Å |
c | 21.2848 ± 0.0004 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 16536 ± 0.7 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 5 |
Space group number | 41 |
Hermann-Mauguin space group symbol | A b a 2 |
Hall space group symbol | A 2 -2ab |
Residual factor for all reflections | 0.1248 |
Residual factor for significantly intense reflections | 0.1044 |
Weighted residual factors for significantly intense reflections | 0.2103 |
Weighted residual factors for all reflections included in the refinement | 0.2221 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.006 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
179610 (current) | 2016-03-24 | cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/74. |
4507431.cif |
91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4507431.cif |
73973 | 2013-02-21 | cif/ Adding structures of 4507431, 4507432 via cif-deposit CGI script. |
4507431.cif |
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Users of the data should acknowledge the original authors of the
structural data.