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Information card for entry 1551668
Preview
Coordinates | 1551668.cif |
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Original paper (by DOI) | HTML |
Formula | C24 H20 Cl2 Fe N2 O2 P |
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Calculated formula | C24 H20 Cl2 Fe N2 O2 P |
Title of publication | Crystal Structure of PPh4[Fe(NO)2Cl2] |
Authors of publication | AKUTSU, Hiroki; YAMADA, Jun-ichi; NAKATSUJI, Shin'ichi; TURNER, Scott S. |
Journal of publication | X-ray Structure Analysis Online |
Year of publication | 2014 |
Journal volume | 30 |
Journal issue | 0 |
Pages of publication | 49 |
a | 18.181 ± 0.003 Å |
b | 18.181 ± 0.003 Å |
c | 7.4559 ± 0.0014 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2464.5 ± 0.7 Å3 |
Cell temperature | 298 K |
Ambient diffraction temperature | 298 K |
Number of distinct elements | 7 |
Space group number | 81 |
Hermann-Mauguin space group symbol | P -4 |
Hall space group symbol | P -4 |
Residual factor for all reflections | 0.1122 |
Residual factor for significantly intense reflections | 0.059 |
Weighted residual factors for significantly intense reflections | 0.1083 |
Weighted residual factors for all reflections included in the refinement | 0.1313 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.03 |
Diffraction radiation wavelength | 0.71075 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
216279 (current) | 2019-06-20 | cif/ Adding structures of 1551668 via cif-deposit CGI script. |
1551668.cif |
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Users of the data should acknowledge the original authors of the
structural data.