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Information card for entry 4331608
Preview
Coordinates | 4331608.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C97 H85 N7 Ni O3 P2 S4 |
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Calculated formula | C95.06 H71 N5.94 Ni O3 P2 S4 |
Title of publication | Influence of the Substituents on the Electronic and Electrochemical Properties of a New Square-Planar Nickel-Bis(quinoxaline-6,7-dithiolate) System: Synthesis, Spectroscopy, Electrochemistry, Crystallography, and Theoretical Investigation |
Authors of publication | Ramababu Bolligarla; Samala Nagaprasad Reddy; Gummadi Durgaprasad; Vudagandla Sreenivasulu; Samar K. Das |
Journal of publication | Inorganic Chemistry |
Year of publication | 2013 |
Journal volume | 52 |
Pages of publication | 66 - 76 |
a | 19.654 ± 0.0012 Å |
b | 19.3493 ± 0.0012 Å |
c | 41.897 ± 0.003 Å |
α | 90° |
β | 102.767 ± 0.001° |
γ | 90° |
Cell volume | 15539.1 ± 1.8 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 7 |
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 | 0.112 |
Residual factor for significantly intense reflections | 0.0875 |
Weighted residual factors for significantly intense reflections | 0.1805 |
Weighted residual factors for all reflections included in the refinement | 0.1924 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.112 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/4331608.html
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