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Information card for entry 4326298
Preview
Coordinates | 4326298.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C54 H36 Cu3 O15 |
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Calculated formula | C54 H30 Cu3 O15 |
Title of publication | Isoreticular Expansion of Metal-Organic Frameworks with Triangular and Square Building Units and the Lowest Calculated Density for Porous Crystals |
Authors of publication | Hiroyasu Furukawa; Yong Bok Go; Nakeun Ko; Young Kwan Park; Fernando J. Uribe-Romo; Jaheon Kim; Michael O'Keeffe; Omar M. Yaghi |
Journal of publication | Inorganic Chemistry |
Year of publication | 2011 |
Journal volume | 50 |
Pages of publication | 9147 - 9152 |
a | 27.4719 ± 0.0014 Å |
b | 27.4719 ± 0.0014 Å |
c | 27.4719 ± 0.0014 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 20733.2 ± 1.8 Å3 |
Cell temperature | 258 ± 2 K |
Ambient diffraction temperature | 258 ± 2 K |
Number of distinct elements | 4 |
Space group number | 223 |
Hermann-Mauguin space group symbol | P m -3 n |
Hall space group symbol | -P 4n 2 3 |
Residual factor for all reflections | 0.1836 |
Residual factor for significantly intense reflections | 0.0623 |
Weighted residual factors for significantly intense reflections | 0.1358 |
Weighted residual factors for all reflections included in the refinement | 0.1788 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.984 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
179365 (current) | 2016-03-23 | cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/62. |
4326298.cif |
91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4326298.cif |
47351 | 2012-03-23 | ../uploads/cif-deposit/cod/cif Adding structures of 4326298 via cif-deposit CGI script. |
4326298.cif |
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Users of the data should acknowledge the original authors of the
structural data.