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Information card for entry 7033815
Preview
Coordinates | 7033815.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C76 H112 Cu2 Fe2 N26 O11 |
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Calculated formula | C76 H104 Cu2 Fe2 N26 O11 |
SMILES | [Cu]12([N]#C[Fe]34([n]5c(c6nc7c(n46)cccc7)cc(cc5c4nc5c(n34)cccc5)c3cc4[n]5[Fe](n6c4nc4ccccc64)(n4c(nc6c4cccc6)c5c3)(C#N)(C#N)C#[N][Cu]34([NH2][C@H]5[C@H]([NH2]3)CCCC5)[NH2][C@H]3[C@H]([NH2]4)CCCC3)(C#N)C#N)([NH2][C@H]3[C@H]([NH2]1)CCCC3)[NH2][C@H]1[C@H]([NH2]2)CCCC1.O=CN(C)C.O=CN(C)C.O.O.O.O.O.OC.O.O.OC |
Title of publication | Synthesis, crystal structures and magnetic properties of mer-cyanideiron(iii)-based 1D heterobimetallic cyanide-bridged chiral coordination polymers. |
Authors of publication | Zhang, Daopeng; Zhuo, Shuping; Zhang, Hongyan; Wang, Ping; Jiang, Jianzhuang |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2015 |
Journal volume | 44 |
Journal issue | 10 |
Pages of publication | 4655 - 4664 |
a | 10.2968 ± 0.0006 Å |
b | 13.7993 ± 0.0008 Å |
c | 17.7819 ± 0.0009 Å |
α | 80.207 ± 0.004° |
β | 84.697 ± 0.004° |
γ | 69.378 ± 0.005° |
Cell volume | 2328.8 ± 0.2 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
Space group number | 1 |
Hermann-Mauguin space group symbol | P 1 |
Hall space group symbol | P 1 |
Residual factor for all reflections | 0.0888 |
Residual factor for significantly intense reflections | 0.0658 |
Weighted residual factors for significantly intense reflections | 0.1646 |
Weighted residual factors for all reflections included in the refinement | 0.1804 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.025 |
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/7033815.html
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