Incorporation of in situ generated 3,3′-(sulfanediyl)bis(1-methyl-1,3-imidazolidine-2-thione) into a one-dimensional CuIcoordination polymer with sulfur-bridged {CuI4S10} n central cores

Tarlok Singh Lobana; Ray J. Butcher; Jerry P. Jasinski; W. T.A. Harrison

doi:10.1107/S2056989022004911

Incorporation of in situ generated 3,3′-(sulfanediyl)bis(1-methyl-1,3-imidazolidine-2-thione) into a one-dimensional Cu^Icoordination polymer with sulfur-bridged {Cu^I4S10} n central cores

Tarlok Singh Lobana^* (Corresponding Author), Ray J. Butcher, Jerry P. Jasinski, W. T.A. Harrison (Editor)

^*Corresponding author for this work

Chemistry

Research output: Contribution to journal › Article › peer-review

1 Citation (Scopus)

Abstract

The reaction of [Cu(CH3CN)4](BF4) with 1-methyl-1,3-imidazolidine-2-thione {SC3H4(NMe)NH}, under aerobic conditions at room temperature, yielded an unusual one-dimensional coordination polymer, namely, catena-poly[[[(1-methyl-1,3-imidazolidine-2-thione-κS)copper(I)]-μ-(1-methyl-1,3-imidazolidine-2-thione)-κ2 S:S-copper(I)-μ-[3,3′-(sulfanediyl)bis(1-methyl-1,3-imidazolidine-2-thione)]-κ5 S,S′,S′′:S,S′′] bis(tetrafluoridoborate)], {[Cu2(C4H8N2S)2(C8H14N4S3)](BF4)2} n or [Cu4(κ5:L 1 - N - S - N - L 1)2(κ1:L 1 - NH)2(κ2:L 1 - NH)2] n (BF4)4n 1 [L 1 = SC3 H4(NMe)NH] with sulfur-bridged {CuI 4S10} n central cores. The in situ generated bis(1-methyl-1,3-imidazolidinyl-2-thione) sulfide [{SC3H4(NMe)NSN(NMe)C3H4S; abbrev. L 1 - N - S - N - L 1] ligand, in combination with 1-methyl-1,3-imidazolidine-2-thione (L 1 - NH) ligands, construct this coordination polymer. Each CuI ion is bonded to four sulfur donor atoms in a distorted tetrahedral geometry and the formation of this polymer solely by sulfur donor atoms with {CuI 4S10} n central cores, is the first such example in copper-heterocyclic-2-thione chemistry.

Original language	English
Pages (from-to)	540-544
Number of pages	5
Journal	Acta Crystallographica Section E: Crystallographic Communications
Volume	78
Issue number	Pt 6
DOIs	https://doi.org/10.1107/S2056989022004911
Publication status	Published - 1 Jun 2022

Bibliographical note

Funding information
JPJ acknowledges the NSF–MRI program (grant No. CHE1039027) for funds to purchase the X-ray diffractometer.

Keywords

copper(I) thione complex
crystal structure
one-dimensional coordination polymer

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Lobana, T. S., Butcher, R. J., Jasinski, J. P., & Harrison, W. T. A. (Ed.) (2022). Incorporation of in situ generated 3,3′-(sulfanediyl)bis(1-methyl-1,3-imidazolidine-2-thione) into a one-dimensional Cu^Icoordination polymer with sulfur-bridged {Cu^I4S10} n central cores. Acta Crystallographica Section E: Crystallographic Communications, 78(Pt 6), 540-544. https://doi.org/10.1107/S2056989022004911

Incorporation of in situ generated 3,3′-(sulfanediyl)bis(1-methyl-1,3-imidazolidine-2-thione) into a one-dimensional Cu^Icoordination polymer with sulfur-bridged {Cu^I4S10} n central cores. / Lobana, Tarlok Singh (Corresponding Author); Butcher, Ray J.; Jasinski, Jerry P. et al.
In: Acta Crystallographica Section E: Crystallographic Communications, Vol. 78, No. Pt 6, 01.06.2022, p. 540-544.

Research output: Contribution to journal › Article › peer-review

Lobana, TS, Butcher, RJ, Jasinski, JP & Harrison, WTA (ed.) 2022, 'Incorporation of in situ generated 3,3′-(sulfanediyl)bis(1-methyl-1,3-imidazolidine-2-thione) into a one-dimensional Cu^Icoordination polymer with sulfur-bridged {Cu^I4S10} n central cores', Acta Crystallographica Section E: Crystallographic Communications, vol. 78, no. Pt 6, pp. 540-544. https://doi.org/10.1107/S2056989022004911

Lobana TS, Butcher RJ, Jasinski JP, Harrison WTA, (ed.). Incorporation of in situ generated 3,3′-(sulfanediyl)bis(1-methyl-1,3-imidazolidine-2-thione) into a one-dimensional Cu^Icoordination polymer with sulfur-bridged {Cu^I4S10} n central cores. Acta Crystallographica Section E: Crystallographic Communications. 2022 Jun 1;78(Pt 6):540-544. doi: 10.1107/S2056989022004911

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title = "Incorporation of in situ generated 3,3′-(sulfanediyl)bis(1-methyl-1,3-imidazolidine-2-thione) into a one-dimensional CuIcoordination polymer with sulfur-bridged {CuI4S10} n central cores",

abstract = "The reaction of [Cu(CH3CN)4](BF4) with 1-methyl-1,3-imidazolidine-2-thione {SC3H4(NMe)NH}, under aerobic conditions at room temperature, yielded an unusual one-dimensional coordination polymer, namely, catena-poly[[[(1-methyl-1,3-imidazolidine-2-thione-κS)copper(I)]-μ-(1-methyl-1,3-imidazolidine-2-thione)-κ2 S:S-copper(I)-μ-[3,3′-(sulfanediyl)bis(1-methyl-1,3-imidazolidine-2-thione)]-κ5 S,S′,S′′:S,S′′] bis(tetrafluoridoborate)], {[Cu2(C4H8N2S)2(C8H14N4S3)](BF4)2} n or [Cu4(κ5:L 1 - N - S - N - L 1)2(κ1:L 1 - NH)2(κ2:L 1 - NH)2] n (BF4)4n 1 [L 1 = SC3 H4(NMe)NH] with sulfur-bridged {CuI 4S10} n central cores. The in situ generated bis(1-methyl-1,3-imidazolidinyl-2-thione) sulfide [{SC3H4(NMe)NSN(NMe)C3H4S; abbrev. L 1 - N - S - N - L 1] ligand, in combination with 1-methyl-1,3-imidazolidine-2-thione (L 1 - NH) ligands, construct this coordination polymer. Each CuI ion is bonded to four sulfur donor atoms in a distorted tetrahedral geometry and the formation of this polymer solely by sulfur donor atoms with {CuI 4S10} n central cores, is the first such example in copper-heterocyclic-2-thione chemistry.",

keywords = "copper(I) thione complex, crystal structure, one-dimensional coordination polymer",

author = "Lobana, {Tarlok Singh} and Butcher, {Ray J.} and Jasinski, {Jerry P.} and Harrison, {W. T.A.}",

note = "Funding information JPJ acknowledges the NSF–MRI program (grant No. CHE1039027) for funds to purchase the X-ray diffractometer.",

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AU - Lobana, Tarlok Singh

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AU - Jasinski, Jerry P.

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N1 - Funding information JPJ acknowledges the NSF–MRI program (grant No. CHE1039027) for funds to purchase the X-ray diffractometer.

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N2 - The reaction of [Cu(CH3CN)4](BF4) with 1-methyl-1,3-imidazolidine-2-thione {SC3H4(NMe)NH}, under aerobic conditions at room temperature, yielded an unusual one-dimensional coordination polymer, namely, catena-poly[[[(1-methyl-1,3-imidazolidine-2-thione-κS)copper(I)]-μ-(1-methyl-1,3-imidazolidine-2-thione)-κ2 S:S-copper(I)-μ-[3,3′-(sulfanediyl)bis(1-methyl-1,3-imidazolidine-2-thione)]-κ5 S,S′,S′′:S,S′′] bis(tetrafluoridoborate)], {[Cu2(C4H8N2S)2(C8H14N4S3)](BF4)2} n or [Cu4(κ5:L 1 - N - S - N - L 1)2(κ1:L 1 - NH)2(κ2:L 1 - NH)2] n (BF4)4n 1 [L 1 = SC3 H4(NMe)NH] with sulfur-bridged {CuI 4S10} n central cores. The in situ generated bis(1-methyl-1,3-imidazolidinyl-2-thione) sulfide [{SC3H4(NMe)NSN(NMe)C3H4S; abbrev. L 1 - N - S - N - L 1] ligand, in combination with 1-methyl-1,3-imidazolidine-2-thione (L 1 - NH) ligands, construct this coordination polymer. Each CuI ion is bonded to four sulfur donor atoms in a distorted tetrahedral geometry and the formation of this polymer solely by sulfur donor atoms with {CuI 4S10} n central cores, is the first such example in copper-heterocyclic-2-thione chemistry.

AB - The reaction of [Cu(CH3CN)4](BF4) with 1-methyl-1,3-imidazolidine-2-thione {SC3H4(NMe)NH}, under aerobic conditions at room temperature, yielded an unusual one-dimensional coordination polymer, namely, catena-poly[[[(1-methyl-1,3-imidazolidine-2-thione-κS)copper(I)]-μ-(1-methyl-1,3-imidazolidine-2-thione)-κ2 S:S-copper(I)-μ-[3,3′-(sulfanediyl)bis(1-methyl-1,3-imidazolidine-2-thione)]-κ5 S,S′,S′′:S,S′′] bis(tetrafluoridoborate)], {[Cu2(C4H8N2S)2(C8H14N4S3)](BF4)2} n or [Cu4(κ5:L 1 - N - S - N - L 1)2(κ1:L 1 - NH)2(κ2:L 1 - NH)2] n (BF4)4n 1 [L 1 = SC3 H4(NMe)NH] with sulfur-bridged {CuI 4S10} n central cores. The in situ generated bis(1-methyl-1,3-imidazolidinyl-2-thione) sulfide [{SC3H4(NMe)NSN(NMe)C3H4S; abbrev. L 1 - N - S - N - L 1] ligand, in combination with 1-methyl-1,3-imidazolidine-2-thione (L 1 - NH) ligands, construct this coordination polymer. Each CuI ion is bonded to four sulfur donor atoms in a distorted tetrahedral geometry and the formation of this polymer solely by sulfur donor atoms with {CuI 4S10} n central cores, is the first such example in copper-heterocyclic-2-thione chemistry.

KW - copper(I) thione complex

KW - crystal structure

KW - one-dimensional coordination polymer

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