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Information card for entry 4345810
Preview
Coordinates | 4345810.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C88 H76 Br8 Cu4 N28 |
---|---|
Calculated formula | C88 H76 Br8 Cu4 N28 |
SMILES | c12ccccc1n1Cc3ccccc3Cn3n[n](c4c3cccc4)[Cu]34([n]5c6c(cccc6)n(Cc6c(Cn7n[n](c8c7cccc8)[Cu]([n]2n1)(Br)([n]1nn(Cc2c(Cn7c8c(cccc8)[n]3n7)cccc2)c2c1cccc2)[n]1c2c(cccc2)n(Cc2c(Cn3n[n]4c4c3cccc4)cccc2)n1)cccc6)n5)Br.[Br]1[Cu](Br)(Br)[Br][Cu]1(Br)Br.C(#N)C.C(#N)C.C(#N)C.C(#N)C |
Title of publication | Cu(II) Coordination Polymers as Vehicles in the A(3) Coupling. |
Authors of publication | Loukopoulos, Edward; Kallitsakis, Michael; Tsoureas, Nikolaos; Abdul-Sada, Alaa; Chilton, Nicholas F.; Lykakis, Ioannis N.; Kostakis, George E. |
Journal of publication | Inorganic chemistry |
Year of publication | 2017 |
Journal volume | 56 |
Journal issue | 9 |
Pages of publication | 4898 - 4910 |
a | 32.215 ± 0.002 Å |
b | 13.4835 ± 0.001 Å |
c | 25.8172 ± 0.0018 Å |
α | 90° |
β | 122.782 ± 0.003° |
γ | 90° |
Cell volume | 9428.2 ± 1.2 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 K |
Number of distinct elements | 5 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.2346 |
Residual factor for significantly intense reflections | 0.1409 |
Weighted residual factors for significantly intense reflections | 0.3466 |
Weighted residual factors for all reflections included in the refinement | 0.3856 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.053 |
Diffraction radiation wavelength | 0.71075 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/4345810.html
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