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Information card for entry 7205133
Preview
Coordinates | 7205133.cif |
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Original paper (by DOI) | HTML |
Formula | C52.88 H39.88 Cl0.24 Fe N0.88 O13 S32 |
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Calculated formula | C52.878 H39.8776 Cl0.2448 Fe N0.8776 O13 S32 |
Title of publication | Effect of electrocrystallization medium on quality, structural features, and conducting properties of single crystals of the (BEDT-TTF)4AI[FeIII(C2O4)3]·G family |
Authors of publication | Prokhorova, T. G.; Buravov, L. I.; Yagubskii, E. B.; Zorina, L. V.; Khasanov, S. S.; Simonov, S. V.; Shibaeva, R. P.; Korobenko, A. V.; Zverev, V. N. |
Journal of publication | CrystEngComm |
Year of publication | 2011 |
Journal volume | 13 |
Journal issue | 2 |
Pages of publication | 537 |
a | 10.4247 ± 0.0007 Å |
b | 19.6843 ± 0.0017 Å |
c | 36.096 ± 0.003 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 7407 ± 1 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 7 |
Space group number | 60 |
Hermann-Mauguin space group symbol | P b c n |
Hall space group symbol | -P 2n 2ab |
Residual factor for all reflections | 0.1355 |
Residual factor for significantly intense reflections | 0.0522 |
Weighted residual factors for significantly intense reflections | 0.1034 |
Weighted residual factors for all reflections included in the refinement | 0.1156 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.009 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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