Lewis-base Adducts of Lead(Ⅱ) Compounds:Synthesis, Structure and Quantum Chemistry Calculation of Mo

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The lead thiocyanate adduct Pb(phen)(SCN)2 (phen = 1,10-phenanthroline) has been prepared by a direct synthetic method and structurally characterized. It presents a mononuclear structure and crystallizes in monoclinic, space group C2/c with a = 17.505(4), b = 13.383(3), c = 6.7916(14) ?, β = 112.25(3)o, V = 1472.6(6) ?3, Z = 4, Dc = 2.271 g/cm3, μ(MoKα) = 11.737 mm-1, F(000) = 936, C14H8N4PbS2, Mr = 503.58, the final R = 0.0446 and wR = 0.1034 for 1601 observed reflections with I > 2σ(I). Structure analysis showed that the lead atom presents an unusual four- coordination geometry with a large vacancy, possibly indicating the stereochemical activity of 6s2 lone pair electrons. It presents a mononuclear structure and crystallizes in monoclinic, space group C2 / c with a (which has been prepared by a direct synthetic method and structurally characterized = 17.505 (4), b = 13.383 (3), c = 6.7916 (14)?,? = 112.25 (3) o, V = 1472.6 (6)? 3, Z = 4, Dc = 2.271 g / cm3, (MoKα) = 11.737 mm-1, F (000) = 936, C14H8N4PbS2, Mr = 503.58, the final R = 0.0446 and wR = 0.1034 for 1601 observed reflections with I> 2σ (I). Structure analysis showed that the lead atom presents an unusual four-coordination geometry with a large vacancy, possibly indicating the stereochemical activity of 6s2 lone pair electrons.
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