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Information card for entry 7015520
Preview
Coordinates | 7015520.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | bis(2-chloro-3-methylpyridine)dibromocopper (II) |
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Formula | C12 H12 Br2 Cl2 Cu N2 |
Calculated formula | C12 H12 Br2 Cl2 Cu N2 |
Title of publication | Copper(II) complexes of 2-halo-3-methylpyridine: synthesis, structure, and magnetic behaviour of Cu(2-X-3-CH(3)py)2X'2 [X, X' = chlorine or bromine; py = pyridine]. |
Authors of publication | Herringer, Susan N.; Turnbull, Mark M.; Landee, Christopher P.; Wikaira, Jan L. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2011 |
Journal volume | 40 |
Journal issue | 16 |
Pages of publication | 4242 - 4252 |
a | 8.6644 ± 0.0002 Å |
b | 8.9944 ± 0.0002 Å |
c | 11.9792 ± 0.0003 Å |
α | 80.235 ± 0.001° |
β | 69.813 ± 0.001° |
γ | 64.1 ± 0.001° |
Cell volume | 788 ± 0.03 Å3 |
Cell temperature | 111 ± 2 K |
Ambient diffraction temperature | 111 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0302 |
Residual factor for significantly intense reflections | 0.0235 |
Weighted residual factors for significantly intense reflections | 0.0622 |
Weighted residual factors for all reflections included in the refinement | 0.0738 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.163 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
179859 (current) | 2016-03-25 | cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/55. |
7015520.cif |
120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7015520.cif |
35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7015520.cif |
21180 | 2011-06-21 | ../uploads/cif-deposit/cod/cif Adding structures of 7015516, 7015517, 7015518, 7015519, 7015520 via cif-deposit CGI script. |
7015520.cif |
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