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Information card for entry 7206002
Preview
Coordinates | 7206002.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C48 H46 Fe3 N4 O16 |
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Calculated formula | C48 H46 Fe3 N4 O16 |
Title of publication | Buffering additive effect in the formation of metal‒carboxylate frameworks with slightly different linear M3(RCOO)6 clusters |
Authors of publication | Wang, Xiao-Feng; Zhang, Yue-Biao; Zhang, Wei-Xiong; Xue, Wei; Zhou, Hao-Long; Chen, Xiao-Ming |
Journal of publication | CrystEngComm |
Year of publication | 2011 |
Journal volume | 13 |
Journal issue | 12 |
Pages of publication | 4196 |
a | 13.3163 ± 0.0017 Å |
b | 18.059 ± 0.002 Å |
c | 21.255 ± 0.003 Å |
α | 90° |
β | 99.7 ± 0.002° |
γ | 90° |
Cell volume | 5038.3 ± 1.1 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.1077 |
Residual factor for significantly intense reflections | 0.0673 |
Weighted residual factors for significantly intense reflections | 0.171 |
Weighted residual factors for all reflections included in the refinement | 0.1974 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.017 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
180391 (current) | 2016-03-26 | cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/60. |
7206002.cif |
120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7206002.cif |
35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7206002.cif |
21308 | 2011-06-22 | ../uploads/cif-deposit/cod/cif Adding structures of 7206002, 7206003 via cif-deposit CGI script. |
7206002.cif |
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Users of the data should acknowledge the original authors of the
structural data.