Bis(4-meth-oxy-chalcone 4-ethyl-thio-semi-carbazon-ato-κ 2 N 1 , S )zinc(II): crystal structure and Hirshfeld surface analysis

• Published in: Acta crystallographica. Section E, Crystallographic communications Crystallographic communications, 2018-02, Vol.74 (Pt 2), p.151-157
• Main Authors: Tan, Ming Yueh, Crouse, Karen A, Ravoof, Thahira B S A, Jotani, Mukesh M, Tiekink, Edward R T
• Format: Article
• Language: English
• Subjects: Research Communications
• ISSN: 2056-9890; 2056-9890
• DOI: 10.1107/S2056989018000282

The title Zn complex, [Zn(C H N OS) ] {systematic name: bis-[( -ethyl- '-{( )-[(2 )-3-(4-meth-oxy-phen-yl)-1-phenyl-prop-2-en-1-yl-idene]amino}-carb-am-im-id-o-yl)sulfanido]zinc(II)}, features a tetra-hedrally coordinated Zn ion within an N S donor set provided by two , -chelating thio-semicarbazone anions. The resulting five-membered Zn,C,N ,S chelate rings adopt different conformations, . almost planar and an envelope with the Zn atom being the flap atom. The configuration about the imine bond within the chelate ring is but those about the exocyclic imine and ethyl-ene bonds are . In the crystal, supra-molecular [100] chains mediated by thio-amide-N-H⋯S(thione) hydrogen bonds and eight-membered thio-amide {⋯HNCS} synthons are observed. A range of inter-actions, including C-H⋯O, C-H⋯π, C-H⋯π(chelate ring) and π(meth-oxy-benzene)-π(chelate ring) consolidate the packing. The Hirshfeld surface analysis performed on the title complex also indicates the influence of the inter-actions involving the chelate rings upon the packing along with the more conventional contacts.