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Crystal structure of 2-[2-(2,5-di-chloro-benz-yloxy)-2-(furan-2-yl)eth-yl]-2H-indazole.

ABSTRACT: In the title compound, C₂₀H₁₆Cl₂N₂O₂, the indazole ring system is approximately planar [maximum deviation = 0.033?(1)?Å], its mean plane is oriented at dihedral angles of 25.04?(4) and 5.10?(4)° to the furan and benzene rings, respectively. In the crystal, pairs of C-H_ind?O_bo (ind = indazole and bo = benz-yloxy) hydrogen bonds link the mol-ecules into centrosymmetric dimers with graph-set motif R₂²(12). Weak C-H?? inter-actions is also observed. Aromatic ?-? stacking between the benzene and the pyrazole rings from neighbouring mol-ecules [centroid-centroid distance = 3.8894?(7)?Å] further consolidates the crystal packing.

SUBMITTER: Ozel Guven O

PROVIDER: S-EPMC5050757 | biostudies-literature | 2016 Oct

REPOSITORIES: biostudies-literature

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Crystal structure of 2-[2-(2,5-di-chloro-benz-yloxy)-2-(furan-2-yl)eth-yl]-2H-indazole.

Özel Güven Özden Ö Türk Gökhan G Adler Philip D F PD Coles Simon J SJ Hökelek Tuncer T

Acta crystallographica. Section E, Crystallographic communications 20160905 Pt 10

In the title compound, C20H16Cl2N2O2, the indazole ring system is approximately planar [maximum deviation = 0.033 (1) Å], its mean plane is oriented at dihedral angles of 25.04 (4) and 5.10 (4)° to the furan and benzene rings, respectively. In the crystal, pairs of C-Hind⋯Obo (ind = indazole and bo = benz-yloxy) hydrogen bonds link the mol-ecules into centrosymmetric dimers with graph-set motif R2 ...[more]

PMID: 27746922

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