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Information card for entry 7700529
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Coordinates | 7700529.cif |
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Original paper (by DOI) | HTML |
Common name | 2a in manuscript |
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Formula | C38 H13 B F15 O P S |
Calculated formula | C38 H13 B F15 O P S |
Title of publication | Organophosphorus-B(C<sub>6</sub>F<sub>5</sub>)<sub>3</sub> adducts: towards new solid-state emitting materials. |
Authors of publication | Regulska, Elzbieta; Christ, Sonja; Zimmermann, Johannes; Rominger, Frank; Hernandez-Sosa, Gerardo; Romero-Nieto, Carlos |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2019 |
Journal volume | 48 |
Journal issue | 34 |
Pages of publication | 12803 - 12807 |
a | 10.0001 ± 0.0003 Å |
b | 29.9868 ± 0.0008 Å |
c | 10.9105 ± 0.0003 Å |
α | 90° |
β | 96.102 ± 0.003° |
γ | 90° |
Cell volume | 3253.21 ± 0.16 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 7 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.072 |
Residual factor for significantly intense reflections | 0.0582 |
Weighted residual factors for significantly intense reflections | 0.106 |
Weighted residual factors for all reflections included in the refinement | 0.1118 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.213 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
224512 (current) | 2019-11-08 | cif/ Updating files of 7700529, 7700530 Original log message: Adding full bibliography for 7700529--7700530.cif. |
7700529.cif |
217047 | 2019-07-16 | cif/ Adding structures of 7700529, 7700530 via cif-deposit CGI script. |
7700529.cif |
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Users of the data should acknowledge the original authors of the
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