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Crystal and mol­ecular structures of some phosphane-substituted cymantrenes [(C(5)H(4) X)Mn(CO)LL′] (X = H or Cl, L = CO, L′ = PPh(3) or PCy(3), and LL’ = Ph(2)PCH(2)CH(2)PPh(2))

UV irradiation of tetra­hydro­furan solutions of [CpMn(CO)(3)] (Cp = π-C(5)H(5) or π-C(5)H(4)Cl) in the presence of the phosphanes PPh(3) or PCy(3) (Cy = cyclo­hex­yl) and Ph(2)PCH(2)CH(2)PPh(2) yields the substitution products [CpMn(CO)(2)PR (3)] (R = Ph or Cy) and [CpMn(CO)(Ph(2)PCH(2)CH(2)PPh(2))...

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Autores principales: Sünkel, Karlheinz, Klein-Hessling, Christian
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8491095/
https://www.ncbi.nlm.nih.gov/pubmed/34607986
http://dx.doi.org/10.1107/S2053229621009177
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author Sünkel, Karlheinz
Klein-Hessling, Christian
author_facet Sünkel, Karlheinz
Klein-Hessling, Christian
author_sort Sünkel, Karlheinz
collection PubMed
description UV irradiation of tetra­hydro­furan solutions of [CpMn(CO)(3)] (Cp = π-C(5)H(5) or π-C(5)H(4)Cl) in the presence of the phosphanes PPh(3) or PCy(3) (Cy = cyclo­hex­yl) and Ph(2)PCH(2)CH(2)PPh(2) yields the substitution products [CpMn(CO)(2)PR (3)] (R = Ph or Cy) and [CpMn(CO)(Ph(2)PCH(2)CH(2)PPh(2))], namely, dicarbon­yl(η(5)-cyclo­penta­dien­yl)(tri­phenyl­phosphane-κP)manganese(I), [Mn(C(5)H(5))(C(18)H(15)P)(CO)(2)], 1a, dicarbon­yl(η(5)-1-chloro­cyclo­penta­dien­yl)(tri­phenyl­phosphane-κP)man­ganese(I), [Mn(C(5)H(4)Cl)(C(18)H(15)P)(CO)(2)], 1b, dicarbon­yl(η(5)-cyclo­penta­dien­yl)(tri­cyclo­hexyl­phosphane-κP)manganese(I), [Mn(C(5)H(5))(C(18)H(33)P)(CO)(2)], 2a, di­carbon­yl(η(5)-1-chloro­cyclo­penta­dien­yl)(tri­cyclo­hexyl­phosphane-κP)manganese(I), [Mn(C(5)H(4)Cl)(C(18)H(33)P)(CO)(2)], 2b, carbon­yl(η(5)-cyclo­penta­dien­yl)[1,2-bis­(di­phenyl­phosphan­yl)ethane-κ(2) P,P′]manganese(I), [Mn(C(5)H(5))(C(26)H(24)P(2))(CO)], 3a, and carbon­yl(η(5)-1-chloro­cyclo­penta­dien­yl)[1,2-bis­(di­phenyl­phosphan­yl)ethane-κ(2) P,P′]manganese(I), [Mn(C(5)H(4)Cl)(C(26)H(24)P(2))(CO)], 3b, The crystal structure determinations show a very small influence of the chlorine substitution and a moderate influence of the phosphane substitution on the bond lengths. The PR (3) groups avoid being eclipsed with the C—Cl bonds. All the com­pounds employ weak C—H⋯O inter­actions for inter­molecular association, which are enhanced by C—H⋯Cl contacts in the chlorinated products.
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spelling pubmed-84910952021-10-08 Crystal and mol­ecular structures of some phosphane-substituted cymantrenes [(C(5)H(4) X)Mn(CO)LL′] (X = H or Cl, L = CO, L′ = PPh(3) or PCy(3), and LL’ = Ph(2)PCH(2)CH(2)PPh(2)) Sünkel, Karlheinz Klein-Hessling, Christian Acta Crystallogr C Struct Chem Research Papers UV irradiation of tetra­hydro­furan solutions of [CpMn(CO)(3)] (Cp = π-C(5)H(5) or π-C(5)H(4)Cl) in the presence of the phosphanes PPh(3) or PCy(3) (Cy = cyclo­hex­yl) and Ph(2)PCH(2)CH(2)PPh(2) yields the substitution products [CpMn(CO)(2)PR (3)] (R = Ph or Cy) and [CpMn(CO)(Ph(2)PCH(2)CH(2)PPh(2))], namely, dicarbon­yl(η(5)-cyclo­penta­dien­yl)(tri­phenyl­phosphane-κP)manganese(I), [Mn(C(5)H(5))(C(18)H(15)P)(CO)(2)], 1a, dicarbon­yl(η(5)-1-chloro­cyclo­penta­dien­yl)(tri­phenyl­phosphane-κP)man­ganese(I), [Mn(C(5)H(4)Cl)(C(18)H(15)P)(CO)(2)], 1b, dicarbon­yl(η(5)-cyclo­penta­dien­yl)(tri­cyclo­hexyl­phosphane-κP)manganese(I), [Mn(C(5)H(5))(C(18)H(33)P)(CO)(2)], 2a, di­carbon­yl(η(5)-1-chloro­cyclo­penta­dien­yl)(tri­cyclo­hexyl­phosphane-κP)manganese(I), [Mn(C(5)H(4)Cl)(C(18)H(33)P)(CO)(2)], 2b, carbon­yl(η(5)-cyclo­penta­dien­yl)[1,2-bis­(di­phenyl­phosphan­yl)ethane-κ(2) P,P′]manganese(I), [Mn(C(5)H(5))(C(26)H(24)P(2))(CO)], 3a, and carbon­yl(η(5)-1-chloro­cyclo­penta­dien­yl)[1,2-bis­(di­phenyl­phosphan­yl)ethane-κ(2) P,P′]manganese(I), [Mn(C(5)H(4)Cl)(C(26)H(24)P(2))(CO)], 3b, The crystal structure determinations show a very small influence of the chlorine substitution and a moderate influence of the phosphane substitution on the bond lengths. The PR (3) groups avoid being eclipsed with the C—Cl bonds. All the com­pounds employ weak C—H⋯O inter­actions for inter­molecular association, which are enhanced by C—H⋯Cl contacts in the chlorinated products. International Union of Crystallography 2021-09-27 /pmc/articles/PMC8491095/ /pubmed/34607986 http://dx.doi.org/10.1107/S2053229621009177 Text en © Sünkel and Klein-Hessling 2021 https://creativecommons.org/licenses/by/4.0/This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.
spellingShingle Research Papers
Sünkel, Karlheinz
Klein-Hessling, Christian
Crystal and mol­ecular structures of some phosphane-substituted cymantrenes [(C(5)H(4) X)Mn(CO)LL′] (X = H or Cl, L = CO, L′ = PPh(3) or PCy(3), and LL’ = Ph(2)PCH(2)CH(2)PPh(2))
title Crystal and mol­ecular structures of some phosphane-substituted cymantrenes [(C(5)H(4) X)Mn(CO)LL′] (X = H or Cl, L = CO, L′ = PPh(3) or PCy(3), and LL’ = Ph(2)PCH(2)CH(2)PPh(2))
title_full Crystal and mol­ecular structures of some phosphane-substituted cymantrenes [(C(5)H(4) X)Mn(CO)LL′] (X = H or Cl, L = CO, L′ = PPh(3) or PCy(3), and LL’ = Ph(2)PCH(2)CH(2)PPh(2))
title_fullStr Crystal and mol­ecular structures of some phosphane-substituted cymantrenes [(C(5)H(4) X)Mn(CO)LL′] (X = H or Cl, L = CO, L′ = PPh(3) or PCy(3), and LL’ = Ph(2)PCH(2)CH(2)PPh(2))
title_full_unstemmed Crystal and mol­ecular structures of some phosphane-substituted cymantrenes [(C(5)H(4) X)Mn(CO)LL′] (X = H or Cl, L = CO, L′ = PPh(3) or PCy(3), and LL’ = Ph(2)PCH(2)CH(2)PPh(2))
title_short Crystal and mol­ecular structures of some phosphane-substituted cymantrenes [(C(5)H(4) X)Mn(CO)LL′] (X = H or Cl, L = CO, L′ = PPh(3) or PCy(3), and LL’ = Ph(2)PCH(2)CH(2)PPh(2))
title_sort crystal and mol­ecular structures of some phosphane-substituted cymantrenes [(c(5)h(4) x)mn(co)ll′] (x = h or cl, l = co, l′ = pph(3) or pcy(3), and ll’ = ph(2)pch(2)ch(2)pph(2))
topic Research Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8491095/
https://www.ncbi.nlm.nih.gov/pubmed/34607986
http://dx.doi.org/10.1107/S2053229621009177
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