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Information card for entry 7036193
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Coordinates | 7036193.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | [Cu2(BmmMe)3](BF4)2 |
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Formula | C27 H36 B2 Cu2 F8 N12 S6 |
Calculated formula | C27 H36 B2 Cu2 F8 N12 S6 |
SMILES | [Cu]123([Cu]45([S]1=C1N(C=CN1CN1C(N(C=C1)C)=[S]24)C)[S]=C1N(C=CN1CN1C(N(C=C1)C)=[S]5)C)[S]=C1N(C=CN1CN1C(N(C=C1)C)=[S]3)C.[B](F)(F)(F)[F-].[B](F)(F)(F)[F-] |
Title of publication | Dinuclear copper(i) complexes with N-heterocyclic thione and selone ligands: synthesis, characterization, and electrochemical studies. |
Authors of publication | Kimani, Martin M.; Watts, David; Graham, Leigh A.; Rabinovich, Daniel; Yap, Glenn P. A.; Brumaghim, Julia L. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2015 |
Journal volume | 44 |
Journal issue | 37 |
Pages of publication | 16313 - 16324 |
a | 14.997 ± 0.007 Å |
b | 15.362 ± 0.007 Å |
c | 17.487 ± 0.008 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 4029 ± 3 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120 ± 2 K |
Number of distinct elements | 7 |
Space group number | 33 |
Hermann-Mauguin space group symbol | P n a 21 |
Hall space group symbol | P 2c -2n |
Residual factor for all reflections | 0.0682 |
Residual factor for significantly intense reflections | 0.0527 |
Weighted residual factors for significantly intense reflections | 0.1267 |
Weighted residual factors for all reflections included in the refinement | 0.1371 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.006 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7036193.html
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