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Information card for entry 4320931
Preview
Coordinates | 4320931.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C44 H96 Cu2 F6 O8 P4 S2 |
---|---|
Calculated formula | C46 H76 Cu2 F6 O6 P4 S2 |
SMILES | C(F)(F)(F)S(=O)(=O)[O-].CCOCC.[P]1(C(C)(C)C)(C(C)(C)C)[Cu]2[P](C[P](C(C)(C)C)(C(C)(C)C)[Cu]2[P](C1)(C(C)(C)C)C(C)(C)C)(C(C)(C)C)C(C)(C)C.C(F)(F)(F)S(=O)(=O)[O-].CCOCC |
Title of publication | A Trigonal Planar μ3-Fluorido Coinage Metal Complex from a Dicationic (Diphosphinomethane)copper(I) Dimer: Syntheses, Structures, and Bonding |
Authors of publication | Bernd F. Straub; Frank Rominger; Peter Hofmann |
Journal of publication | Inorganic Chemistry |
Year of publication | 2000 |
Journal volume | 39 |
Pages of publication | 2113 - 2119 |
a | 20.2467 ± 0.0001 Å |
b | 41.775 ± 0.0004 Å |
c | 13.6175 ± 0.0002 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 11517.8 ± 0.2 Å3 |
Cell temperature | 200 ± 2 K |
Ambient diffraction temperature | 200 ± 2 K |
Number of distinct elements | 7 |
Space group number | 43 |
Hermann-Mauguin space group symbol | F d d 2 |
Hall space group symbol | F 2 -2d |
Residual factor for all reflections | 0.0316 |
Residual factor for significantly intense reflections | 0.0297 |
Weighted residual factors for significantly intense reflections | 0.073 |
Weighted residual factors for all reflections included in the refinement | 0.074 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.048 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
179312 (current) | 2016-03-23 | cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/09. |
4320931.cif |
120105 | 2014-07-12 | Adding DOIs to range 4/32 structures. | 4320931.cif |
34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4320931.cif |
18253 | 2011-04-28 | ../uploads/cif-deposit/cod/cif Adding structures of 4320931 via cif-deposit CGI script. |
4320931.cif |
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Users of the data should acknowledge the original authors of the
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