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2-{2-[5-(4-Cyano-5-dicyanomethylidene-2,2-dimethyl-2,5-dihydrofuran-3-yl)penta-2,4-dienylidene]-3,3-dimethyl-2,3-dihydro-1H-indol-1-yl}ethyl 3,5-bis(benzyloxy)benzoate
In the title molecule, C(48)H(42)N(4)O(5), a potential non-linear optical compound, the furan ring [r.m.s. deviation = 0.010 (1) Å] and the indolylidene ring system [r.m.s. deviation = 0.013 (2) Å] are inclined to one another by 18.52 (6)°. This is similar to the arrangement [16.51 (18)°] found fo...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2013
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3914075/ https://www.ncbi.nlm.nih.gov/pubmed/24526976 http://dx.doi.org/10.1107/S1600536813032868 |
Sumario: | In the title molecule, C(48)H(42)N(4)O(5), a potential non-linear optical compound, the furan ring [r.m.s. deviation = 0.010 (1) Å] and the indolylidene ring system [r.m.s. deviation = 0.013 (2) Å] are inclined to one another by 18.52 (6)°. This is similar to the arrangement [16.51 (18)°] found for the N-hydroxyethyl adduct of the title compound [Bhuiyan et al. (2011 ▶). Mol. Cryst. Liq. Cryst. 548, 1–12]. Replacing the hydroxyethyl group with 3,5-dibenzyloxybenzoate has not resulted in a non-centrosymmetric lattice arrangement or significant changes to the basic molecular structure. In the crystal, molecules are linked via pairs of C—H⋯N hydrogen bonds, forming inversion dimers with an R (2) (2)(20) ring motif. The dimers are linked via C—H⋯O hydrogen bonds, forming C(17) chains along [010]. The chains are linked by further C—H⋯N hydrogen bonds, forming layers parallel to (001) and enclosing R (2) (2)(44) ring motifs. There are also C—H⋯π interactions present, stabilizing the interlayer orientation of the pendant bis(benzyloxy)benzoyloxy group. |
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