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Information card for entry 7005217
Preview
Coordinates | 7005217.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C60 H78 N6 O2 P2 Pt |
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Calculated formula | C60 H78 N6 O2 P2 Pt |
SMILES | c1(c2cc(cc(n2)c2ccccn2)OCC#C[Pt]([P](CCCC)(CCCC)CCCC)([P](CCCC)(CCCC)CCCC)C#CCOc2cc(c3ccccn3)nc(c2)c2ncccc2)ncccc1 |
Title of publication | [n + n]-Heterometallomacrocyclic complexes (n > or = 2) prepared from platinum(II)-centred ditopic 2,2':6',2''-terpyridine ligands: dimensional cataloguing by pulsed-field gradient spin-echo NMR spectroscopy. |
Authors of publication | Beves, Jonathon E.; Constable, Edwin C.; Housecroft, Catherine E.; Neuburger, Markus; Schaffner, Silvia; Shardlow, Ellen J. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2007 |
Journal issue | 16 |
Pages of publication | 1593 - 1602 |
a | 9.3983 ± 0.0001 Å |
b | 10.9971 ± 0.0001 Å |
c | 13.7916 ± 0.0001 Å |
α | 100.652 ± 0.0006° |
β | 99.7287 ± 0.0006° |
γ | 91.2631 ± 0.0006° |
Cell volume | 1378.62 ± 0.02 Å3 |
Cell temperature | 123 K |
Ambient diffraction temperature | 123 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 | 0.0206 |
Residual factor for significantly intense reflections | 0.0203 |
Weighted residual factors for all reflections | 0.0229 |
Weighted residual factors for significantly intense reflections | 0.0228 |
Weighted residual factors for all reflections included in the refinement | 0.0228 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.0943 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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