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Information card for entry 7034716
Preview
Coordinates | 7034716.cif |
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Original paper (by DOI) | HTML |
Formula | C84 H157 Gd5 N2 O47 P6 |
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Calculated formula | C84 H157 Gd5 N2 O47 P6 |
Title of publication | Discrete {Gd(III)4M} (M = Gd(III) or Co(II)) pentanuclear complexes: a new class of metal-organophosphate molecular coolers. |
Authors of publication | Gupta, Sandeep K.; Dar, Aijaz A.; Rajeshkumar, Thayalan; Kuppuswamy, Subramaniam; Langley, Stuart K.; Murray, Keith S.; Rajaraman, Gopalan; Murugavel, Ramaswamy |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2015 |
Journal volume | 44 |
Journal issue | 13 |
Pages of publication | 5961 - 5965 |
a | 14.11 ± 0.003 Å |
b | 16.918 ± 0.003 Å |
c | 25.38 ± 0.004 Å |
α | 99.378 ± 0.003° |
β | 90.744 ± 0.004° |
γ | 105.488 ± 0.003° |
Cell volume | 5750.3 ± 1.8 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 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 | 0.0596 |
Residual factor for significantly intense reflections | 0.0552 |
Weighted residual factors for significantly intense reflections | 0.1244 |
Weighted residual factors for all reflections included in the refinement | 0.1302 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.145 |
Diffraction radiation wavelength | 0.71075 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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