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Crystal structure and spectroscopic study of 6a,7a,13b,13c-tetrahydro-6a-hydroxy-2,3,11,12-tetramethoxy-6,6,8,8-tetramethyl-6H,8H-bischromeno-[3,4-b:4′,3′-d]furan,a dimer of precocene II 3,4-epoxide
Authors:F. Camps  J. Coll  A. Conchillo  A. Messeguer  E. Molins  C. Miravitlles
Affiliation:(1) Instituto de Química Bio-Orgánica (C.S.I.C.), J. Girona Salgado, 18-26, 08034 Barcelona, Spain;(2) Instituto "ldquo"Jaime Almera"rdquo" (C.S.I.C.), c. Martí Franqués, s/n Apto. 30.102, 08034 Barcelona, Spain
Abstract:The X-ray crystal structure of the title compound has been determined. The crystals are orthorhombic:Pcab, a=9.857(5),b=15.274(5),c=32.601(14) Å,Vc=4908.4 Å3;Z=8;Dx=1.279 Mg m–3; lambda(MoKagr)=0.71069 Å;mgr=0.88 cm–1,F(000)=2016, temperature of measurement 294 K. The structure was solved by direct methods, and refined with 932 reflections to a finalR value of 0.071. The two six-membered rings show distorted boat conformations and the tetrahydrofuran ring exhibits a half-chair conformation. Mass spectra, IR spectrum, and1H and13C NMR spectra are also reported.
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