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Information card for entry 7015476
Preview
Coordinates | 7015476.cif |
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Original paper (by DOI) | HTML |
Formula | C29 H22 F6 Fe2 N4 |
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Calculated formula | C29 H22 F6 Fe2 N4 |
Title of publication | Synthesis, crystal structure, electrochemistry and in situ FTIR spectroelectrochemistry of a bisferrocene pyrazole derivative. |
Authors of publication | Zhang, Qiong; Song, Wen-Li; Showkot Hossain, A. M.; Liu, Zhao-Di; Hu, Gui-Ju; Tian, Yu-Peng; Wu, Jie-Ying; Jin, Bao-Kang; Zhou, Hong-Ping; Yang, Jia-Xiang; Zhang, Sheng-Yi |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2011 |
Journal volume | 40 |
Journal issue | 14 |
Pages of publication | 3510 - 3516 |
a | 12.2286 ± 0.0009 Å |
b | 17.4493 ± 0.0013 Å |
c | 25.3574 ± 0.0019 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 5410.8 ± 0.7 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 2 K |
Number of distinct elements | 5 |
Space group number | 61 |
Hermann-Mauguin space group symbol | P b c a |
Hall space group symbol | -P 2ac 2ab |
Residual factor for all reflections | 0.0572 |
Residual factor for significantly intense reflections | 0.0424 |
Weighted residual factors for significantly intense reflections | 0.1417 |
Weighted residual factors for all reflections included in the refinement | 0.1563 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.17 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
179858 (current) | 2016-03-25 | cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/54. |
7015476.cif |
120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7015476.cif |
35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7015476.cif |
21163 | 2011-06-21 | ../uploads/cif-deposit/cod/cif Adding structures of 7015476 via cif-deposit CGI script. |
7015476.cif |
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