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Information card for entry 7238814
Preview
Coordinates | 7238814.cif |
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Original paper (by DOI) | HTML |
Formula | C69 H63 Fe3 N3 O3 |
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Calculated formula | C69 H63 Fe3 N3 O3 |
Title of publication | C3 symmetric ferrocenyl triazines: synthesis, structure, and properties |
Authors of publication | Maragani, Ramesh; Jadhav, Thaksen; Mobin, Shaikh M.; Misra, Rajneesh |
Journal of publication | RSC Advances |
Year of publication | 2013 |
Journal volume | 3 |
Journal issue | 9 |
Pages of publication | 2889 |
a | 11.75 ± 0.005 Å |
b | 15.514 ± 0.005 Å |
c | 16.213 ± 0.005 Å |
α | 72.754 ± 0.005° |
β | 85.225 ± 0.005° |
γ | 73.299 ± 0.005° |
Cell volume | 2703.5 ± 1.7 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0839 |
Residual factor for significantly intense reflections | 0.072 |
Weighted residual factors for significantly intense reflections | 0.2014 |
Weighted residual factors for all reflections included in the refinement | 0.2135 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.038 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
244370 (current) | 2019-11-28 | cif/ Adding structures of 7238814 via cif-deposit CGI script. |
7238814.cif |
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structural data.