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Information card for entry 7220331
Preview
Coordinates | 7220331.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C36 H21 Cl2 Cu N3 O6 |
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Calculated formula | C36 H21 Cl2 Cu N3 O6 |
Title of publication | Interfacial effects of crystal surface through free quinolinyl groups on crystal organization and catalysis |
Authors of publication | Kim, Byung Joo; Lee, Haeri; Noh, Tae Hwan; Jung, Ok-Sang |
Journal of publication | CrystEngComm |
Year of publication | 2015 |
Journal volume | 17 |
Journal issue | 23 |
Pages of publication | 4281 |
a | 26.648 ± 0.003 Å |
b | 14.3871 ± 0.0011 Å |
c | 15.1191 ± 0.001 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 5796.5 ± 0.9 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 6 |
Space group number | 64 |
Hermann-Mauguin space group symbol | C m c a |
Hall space group symbol | -C 2ac 2 |
Residual factor for all reflections | 0.2665 |
Residual factor for significantly intense reflections | 0.2272 |
Weighted residual factors for significantly intense reflections | 0.5573 |
Weighted residual factors for all reflections included in the refinement | 0.5743 |
Goodness-of-fit parameter for all reflections included in the refinement | 2.242 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
176428 (current) | 2016-02-13 | Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively. |
7220331.cif |
138549 | 2015-06-07 | cif/ Updating files of 7220331, 7220332, 7220333, 7220334 Original log message: Adding full bibliography for 7220331--7220334.cif. |
7220331.cif |
135834 | 2015-05-09 | cif/ Adding structures of 7220331, 7220332, 7220333, 7220334 via cif-deposit CGI script. |
7220331.cif |
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Users of the data should acknowledge the original authors of the
structural data.