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Information card for entry 4323361
Preview
Coordinates | 4323361.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | Dibromo-(2-methoxy-1,3-bis(triphenylphosphonio)-isophosphindol)- quecksilber(II) |
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Formula | C47 H41 Br2 Cl4 Hg O P3 |
Calculated formula | C47 H41 Br2 Cl4 Hg O P3 |
SMILES | [Hg](Br)(Br)[P]1(OC)C(c2ccccc2C1=P(c1ccccc1)(c1ccccc1)c1ccccc1)=P(c1ccccc1)(c1ccccc1)c1ccccc1.C(Cl)Cl.C(Cl)Cl |
Title of publication | Reactions of Bis(triphenylphosphonio)isophosphindolide Salts with Mercury(II) Compounds: Coordination Induced Addition and Oxidation Reactions and Synthesis of a Monomeric 1:1 Complex of the Type [R2(R'O)P]HgBr2 |
Authors of publication | Dietrich Gudat; Martin Nieger; Martin Schrott |
Journal of publication | Inorganic Chemistry |
Year of publication | 1997 |
Journal volume | 36 |
Pages of publication | 1476 - 1481 |
a | 20.028 ± 0.002 Å |
b | 15.513 ± 0.002 Å |
c | 30.247 ± 0.008 Å |
α | 90° |
β | 91.91 ± 0.01° |
γ | 90° |
Cell volume | 9392 ± 3 Å3 |
Cell temperature | 208 ± 2 K |
Ambient diffraction temperature | 208 ± 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 | 0.0698 |
Residual factor for significantly intense reflections | 0.0568 |
Weighted residual factors for all reflections | 0.1774 |
Weighted residual factors for significantly intense reflections | 0.1648 |
Goodness-of-fit parameter for all reflections | 1.115 |
Goodness-of-fit parameter for significantly intense reflections | 1.145 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKa |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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