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Information card for entry 4087187
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Coordinates | 4087187.cif |
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Original paper (by DOI) | HTML |
Formula | C7 H8 Au Br N2 |
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Calculated formula | C7 H8 Au Br N2 |
Title of publication | Synthesis of Propargyl-Functionalized NHC Gold Complexes |
Authors of publication | Johnson, Alice; Gimeno, M. Concepción |
Journal of publication | Organometallics |
Year of publication | 2017 |
Journal volume | 36 |
Journal issue | 7 |
Pages of publication | 1278 |
a | 7.505 ± 0.0015 Å |
b | 8.0571 ± 0.0016 Å |
c | 9.044 ± 0.0018 Å |
α | 101.39 ± 0.03° |
β | 102.75 ± 0.03° |
γ | 117.48 ± 0.03° |
Cell volume | 444 ± 0.3 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 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 | 0.0191 |
Residual factor for significantly intense reflections | 0.0184 |
Weighted residual factors for significantly intense reflections | 0.0461 |
Weighted residual factors for all reflections included in the refinement | 0.0464 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.109 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
196166 (current) | 2017-05-05 | cif/ Updating files of 4087187, 4087188, 4087189, 4087190 Original log message: Adding full bibliography for 4087187--4087190.cif. |
4087187.cif |
194552 | 2017-03-28 | cif/ Adding structures of 4087187 via cif-deposit CGI script. |
4087187.cif |
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Users of the data should acknowledge the original authors of the
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