Information card for entry 7705702
| Formula |
C68 H72 Cu F16 N12 Na2 O12 |
| Calculated formula |
C68 H72 Cu F16 N12 Na2 O12 |
| Title of publication |
Effect of reduction on the molecular structure and optical and magnetic properties of fluorinated copper(II) phthalocyanines. |
| Authors of publication |
Konarev, Dmitri V.; Faraonov, Maxim A.; Batov, Mikhail S.; Andronov, Mikhail G.; Kuzmin, Alexey V.; Khasanov, Salavat S.; Otsuka, Akihiro; Yamochi, Hideki; Kitagawa, Hiroshi; Lyubovskaya, Rimma N. |
| Journal of publication |
Dalton transactions (Cambridge, England : 2003) |
| Year of publication |
2020 |
| Journal volume |
49 |
| Journal issue |
46 |
| Pages of publication |
16821 - 16829 |
| a |
22.0273 ± 0.0005 Å |
| b |
11.7156 ± 0.0002 Å |
| c |
30.592 ± 0.0007 Å |
| α |
90° |
| β |
108.615 ± 0.002° |
| γ |
90° |
| Cell volume |
7481.7 ± 0.3 Å3 |
| Cell temperature |
117.6 ± 0.9 K |
| Ambient diffraction temperature |
118 K |
| Number of distinct elements |
7 |
| Space group number |
15 |
| Hermann-Mauguin space group symbol |
I 1 2/a 1 |
| Hall space group symbol |
-I 2ya |
| Residual factor for all reflections |
0.069 |
| Residual factor for significantly intense reflections |
0.0435 |
| Weighted residual factors for significantly intense reflections |
0.0964 |
| Weighted residual factors for all reflections included in the refinement |
0.1065 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.022 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
No |
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