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Information card for entry 4345956
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Coordinates | 4345956.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C59.8 H83.2 Cd2 Cl4 N16 O15.8 |
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Calculated formula | C59.8 H76 Cd2 Cl4 N16 O15.8 |
Title of publication | Dinuclear Metallacycles with Single M-X-M Bridges (X = Cl(-), Br(-); M = Fe(II), Co(II), Ni(II), Cu(II), Zn(II), Cd(II)): Strong Antiferromagnetic Superexchange Interactions. |
Authors of publication | Reger, Daniel L.; Pascui, Andrea E.; Foley, Elizabeth A.; Smith, Mark D.; Jezierska, Julia; Wojciechowska, Agnieszka; Stoian, Sebastian A.; Ozarowski, Andrew |
Journal of publication | Inorganic chemistry |
Year of publication | 2017 |
a | 25.3217 ± 0.0014 Å |
b | 13.5025 ± 0.0007 Å |
c | 22.8451 ± 0.0012 Å |
α | 90° |
β | 114.81 ± 0.001° |
γ | 90° |
Cell volume | 7090 ± 0.7 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
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 | 0.0496 |
Residual factor for significantly intense reflections | 0.0379 |
Weighted residual factors for significantly intense reflections | 0.0903 |
Weighted residual factors for all reflections included in the refinement | 0.097 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.045 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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