Dichloridobis(2-methyl-1,3-benzothiazole-κ<i>N</i>)zinc(II)

Roh, Soo-Gyun; Jeong, Jong Hwa

doi:10.1107/s1600536807039104

Cited by 2 publications

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“…The structural parameters of compound 1 can also be compared to that of the formal C 1 symmetric compound ZnCl 2 (2-methyl-1,3-benzothiazole-k 1 N) 2 which displays a similar t 4 value (0.925) and metal-ligand binding characteristics. 28,31 Palladium complexes. Fig.…”

Section: Crystallography and Molecular Structurementioning

confidence: 99%

“…2,30 All three of these complexes also display solid-state C 1 molecular symmetry and hence each has two structurally unique halide and azole ligands. The structural parameters of compound 1 can also be compared to that of the formal C 1 symmetric compound ZnCl 2 (2-methyl-1,3-benzothiazole-k 1 N) 2 which displays a similar t 4 value (0.925) and metal-ligand binding characteristics 28,31.…”

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Oxazoles revisited: On the nature of binding of benzoxazole and 2-methylbenzoxazole with the zinc and palladium halides

et al. 2011

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A synthetic and structural (X-ray) investigation into the bonding modes of benzoxazole (box) and 2-methylbenzoxazole (Mebox) ligands with halide precursors of Zn and Pd has been undertaken to clarify earlier discrepancies concerning the nature of the bonding mode(s) of the two azoles. In four structurally characterised examples, all contain the title ligands in a κ(1)N bonding motif. Calculations at the density functional level (DFT) of theory (B3LYP) confirm the ground state stability of this class of coordination for several hypothetical Pd and Zn (gas phase) compounds. The attempt to obtain suitable crystalline material of PdCl(2)(box)(2) (i.e., 5) leads to substantial complex degradation. One minor product of this process has been identified (X-ray) as the diarylformamidinato complex C(26)H(22)N(4)O(4)Pd, presumably formed via a complex combination of the decomposition products of both free box and 5.

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Section: Crystallography and Molecular Structurementioning

confidence: 99%

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confidence: 99%

Oxazoles revisited: On the nature of binding of benzoxazole and 2-methylbenzoxazole with the zinc and palladium halides

et al. 2011

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catena-Poly[[trans-bis(1,3-benzothiazole-κN)manganese(II)]-di-μ-chlorido]

et al. 2014

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In the title coordination polymer, [MnCl2(C7H5NS)2]n, the MnII ion is located on the intersection of a twofold rotation axis and a mirror plane and adopts an octahedral coordination geometry defined by two mutually trans N atoms from benzothiazole ligands which occupy the axial positions, and four Cl atoms which form the equatorial sites. The MnII ions are connected by two bridging Cl atoms, forming chains parallel to the c axis. The crystal packing can be descibed as alternating layers parallel to (001) featuring π–π stacking interactions with a centroid–centroid distance of 3.6029 (15) Å.

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Dichloridobis(2-methyl-1,3-benzothiazole-κN)zinc(II)

Abstract: Key indicators: single-crystal X-ray study; T = 293 K; mean (C-C) = 0.004 Å; R factor = 0.026; wR factor = 0.076; data-to-parameter ratio = 15.5.

Cited by 2 publications

References 6 publications

Oxazoles revisited: On the nature of binding of benzoxazole and 2-methylbenzoxazole with the zinc and palladium halides

Oxazoles revisited: On the nature of binding of benzoxazole and 2-methylbenzoxazole with the zinc and palladium halides

catena-Poly[[trans-bis(1,3-benzothiazole-κN)manganese(II)]-di-μ-chlorido]

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