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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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Formato: | Online Artículo Texto |
Lenguaje: | English |
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International Union of Crystallography
2021
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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. |
format | Online Article Text |
id | pubmed-8491095 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2021 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
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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