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Information card for entry 7027747
Preview
Coordinates | 7027747.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C51 H56 N6 O2 P2 Pd2 S2 |
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Calculated formula | C51 H56 N6 O2 P2 Pd2 S2 |
SMILES | c12[Pd]3([N](=C(c2cccc1)CC)N=C(N)S3)[P](C[P](c1ccccc1)(c1ccccc1)[Pd]12c3ccccc3C(CC)=[N]1N=C(N)S2)(c1ccccc1)c1ccccc1.O=C(C)C.O=C(C)C |
Title of publication | Formation, characterization, and structural studies of novel thiosemicarbazone palladium(II) complexes. Crystal structures of [{Pd[C6H4C(Et)NNC(S)NH2]}4], [Pd{C6H4C(Et)NN C(S)NH2}(PMePh2)] and [{Pd[C6H4C(Et)NNC(S)NH2]}2(μ-Ph2PCH2PPh2)] |
Authors of publication | Vila, José M.; Pereira, Ma Teresa; Ortigueira, Juan M.; Graña, María; Lata, Darío; Suárez, Antonio; Fernández, Jesús J.; Fernández, Alberto; López-Torres, Margarita; Adams, Harry |
Journal of publication | Journal of the Chemical Society, Dalton Transactions |
Year of publication | 1999 |
Journal issue | 23 |
Pages of publication | 4193 |
a | 13.8547 ± 0.0002 Å |
b | 17.8565 ± 0.0002 Å |
c | 21.1184 ± 0.0001 Å |
α | 93.937 ± 0.001° |
β | 90.993 ± 0.001° |
γ | 92.3° |
Cell volume | 5207.03 ± 0.1 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 7 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1334 |
Residual factor for significantly intense reflections | 0.0613 |
Weighted residual factors for significantly intense reflections | 0.1121 |
Weighted residual factors for all reflections included in the refinement | 0.1424 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.025 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7027747.html
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