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Crystal and Molecular Structure of Desmodin
Authors:A Abdul Ajees  K Sekar  S Parthasarathy  K Balakrishna
Abstract:The crystal structure of the title compound has been determined from X‐ray diffraction. The compound crystallizes from benzene in the orthorhombic system, space group P212121, with unit cell parameters: a = 8.485(2), b = 9.816(2), c = 22.597(4) Å, Z = 4, V = 1881.9(7) Å3. The structure was determined by direct methods and refined to a final R‐factor of 0.04. Six membered rings B and E are planar. Ring A and ring C are in slightly distorted sofa conformation. Ring D is in envelope conformation. The structure is stabilised by weak intermolecular C‐H...O hydrogen bonds.
Keywords:Desmodin  medicinal  plant product  X‐ray structure  C‐H      O hydrogen bonds
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