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Information card for entry 4081971
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Coordinates | 4081971.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C84 H88 N8 Ru4 |
---|---|
Calculated formula | C84 H88 N8 Ru4 |
SMILES | c1ccc2c3[n]1[Ru]14567([n]8cccc(C2[Ru]29%10%11%12([n]%13cccc%14c%13c%13[n]%10cccc%13C%14[Ru]%10%13%14%15%16([n]%17cccc%18c%17c%17c(ccc[n]%10%17)C%18[Ru]%10%17%18%19%20([n]%21cccc%22c%21c%21[n]%10cccc%21C1%22)[c]1([c]%18([c]%20([c]%19([c]%171C)C)C)C)C)[c]1([c]%13([c]%15([c]%16([c]%141C)C)C)C)C)[c]1([c]2([c]9([c]%12([c]%111C)C)C)C)C)c38)[c]1([c]5([c]7([c]6([c]41C)C)C)C)C |
Title of publication | RuCp* Complexes of Ambidentate 4,5-Diazafluorene Derivatives: From Linkage Isomers to Coordination-Driven Self-Assembly |
Authors of publication | Annibale, Vincent T.; Batcup, Rhys; Bai, Tao; Hughes, Sarah J.; Song, Datong |
Journal of publication | Organometallics |
Year of publication | 2013 |
Journal volume | 32 |
Journal issue | 21 |
Pages of publication | 6511 |
a | 23.311 ± 0.0007 Å |
b | 14.1997 ± 0.0004 Å |
c | 16.9207 ± 0.0005 Å |
α | 90° |
β | 130.526 ± 0.001° |
γ | 90° |
Cell volume | 4257.3 ± 0.2 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 4 |
Space group number | 12 |
Hermann-Mauguin space group symbol | C 1 2/m 1 |
Hall space group symbol | -C 2y |
Residual factor for all reflections | 0.0317 |
Residual factor for significantly intense reflections | 0.0281 |
Weighted residual factors for significantly intense reflections | 0.0895 |
Weighted residual factors for all reflections included in the refinement | 0.091 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.144 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4081971.html
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