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Different reductive reactivities of SmCpx 2(THF)n (Cpx = C5Me5 and C5H3 tBu2) samarocenes toward P2Ph4 : THF ring-opening and ligand-exchange pathways. / Pushkarevsky, Nikolay A.; Ilyin, Igor Yu; Petrov, Pavel A. et al.

In: Organometallics, Vol. 36, No. 7, 10.04.2017, p. 1287-1295.

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@article{d0aa61c75d644abc820a6855801b79d9,
title = "Different reductive reactivities of SmCpx 2(THF)n (Cpx = C5Me5 and C5H3 tBu2) samarocenes toward P2Ph4: THF ring-opening and ligand-exchange pathways",
abstract = "The reduction of tetraphenyldiphosphine with two differently substituted samarocenes(II) proceeds via different pathways. With [SmCp∗ 2(THF)2] (Cp∗ = η5- C5Me5), the reaction had been known to result in the THF ring-opening product, [SmCp∗ 2(O(CH2)4PPh2)], 3, owing to the instability of phosphido complex [SmCp∗ 2(PPh2)] in the presence of THF. Complex 3 crystallizes from apolar solvents as dimeric or polymeric polymorph with butoxo-phosphine bridging ligands in both cases. In contrast, the phosphide [SmCp″2(PPh2)] (Cp″ = η5-1,3-C5H3 tBu2), 5, is not prone to ring-opening owing to insufficient space in the Sm coordination sphere for a THF ligand. Product 5 is inevitably accompanied by homoleptic complex [SmCp″3] 6 and dinuclear mixed-valent complex [SmIIICp″2(μ-PPh2)2SmIICp″] 7 as the further products of redox transformations and ligand exchange. The formation of 5-7 is rationalized by a sequence of initial coordination of one or two {SmIICp″2} fragments by P atoms and reductive elimination of PPh2· or Cp″·E radicals. Further reaction with another equivalent of [SmCp″2] results in the trapping the radicals and formation of all three products.",
keywords = "RAY CRYSTAL-STRUCTURE, DIVALENT LANTHANIDE CHEMISTRY, RARE-EARTH-ELEMENTS, ELECTRON-DENSITY, STRUCTURAL-CHARACTERIZATION, MOLECULAR-COMPLEXES, SUPERBULKY LIGANDS, OXIDATION-STATE, BOND FORMATION, BASIS-SETS",
author = "Pushkarevsky, {Nikolay A.} and Ilyin, {Igor Yu} and Petrov, {Pavel A.} and Samsonenko, {Denis G.} and Ryzhikov, {Maxim R.} and Roesky, {Peter W.} and Konchenko, {Sergey N.}",
year = "2017",
month = apr,
day = "10",
doi = "10.1021/acs.organomet.7b00014",
language = "English",
volume = "36",
pages = "1287--1295",
journal = "Organometallics",
issn = "0276-7333",
publisher = "American Chemical Society",
number = "7",

}

RIS

TY - JOUR

T1 - Different reductive reactivities of SmCpx 2(THF)n (Cpx = C5Me5 and C5H3 tBu2) samarocenes toward P2Ph4

T2 - THF ring-opening and ligand-exchange pathways

AU - Pushkarevsky, Nikolay A.

AU - Ilyin, Igor Yu

AU - Petrov, Pavel A.

AU - Samsonenko, Denis G.

AU - Ryzhikov, Maxim R.

AU - Roesky, Peter W.

AU - Konchenko, Sergey N.

PY - 2017/4/10

Y1 - 2017/4/10

N2 - The reduction of tetraphenyldiphosphine with two differently substituted samarocenes(II) proceeds via different pathways. With [SmCp∗ 2(THF)2] (Cp∗ = η5- C5Me5), the reaction had been known to result in the THF ring-opening product, [SmCp∗ 2(O(CH2)4PPh2)], 3, owing to the instability of phosphido complex [SmCp∗ 2(PPh2)] in the presence of THF. Complex 3 crystallizes from apolar solvents as dimeric or polymeric polymorph with butoxo-phosphine bridging ligands in both cases. In contrast, the phosphide [SmCp″2(PPh2)] (Cp″ = η5-1,3-C5H3 tBu2), 5, is not prone to ring-opening owing to insufficient space in the Sm coordination sphere for a THF ligand. Product 5 is inevitably accompanied by homoleptic complex [SmCp″3] 6 and dinuclear mixed-valent complex [SmIIICp″2(μ-PPh2)2SmIICp″] 7 as the further products of redox transformations and ligand exchange. The formation of 5-7 is rationalized by a sequence of initial coordination of one or two {SmIICp″2} fragments by P atoms and reductive elimination of PPh2· or Cp″·E radicals. Further reaction with another equivalent of [SmCp″2] results in the trapping the radicals and formation of all three products.

AB - The reduction of tetraphenyldiphosphine with two differently substituted samarocenes(II) proceeds via different pathways. With [SmCp∗ 2(THF)2] (Cp∗ = η5- C5Me5), the reaction had been known to result in the THF ring-opening product, [SmCp∗ 2(O(CH2)4PPh2)], 3, owing to the instability of phosphido complex [SmCp∗ 2(PPh2)] in the presence of THF. Complex 3 crystallizes from apolar solvents as dimeric or polymeric polymorph with butoxo-phosphine bridging ligands in both cases. In contrast, the phosphide [SmCp″2(PPh2)] (Cp″ = η5-1,3-C5H3 tBu2), 5, is not prone to ring-opening owing to insufficient space in the Sm coordination sphere for a THF ligand. Product 5 is inevitably accompanied by homoleptic complex [SmCp″3] 6 and dinuclear mixed-valent complex [SmIIICp″2(μ-PPh2)2SmIICp″] 7 as the further products of redox transformations and ligand exchange. The formation of 5-7 is rationalized by a sequence of initial coordination of one or two {SmIICp″2} fragments by P atoms and reductive elimination of PPh2· or Cp″·E radicals. Further reaction with another equivalent of [SmCp″2] results in the trapping the radicals and formation of all three products.

KW - RAY CRYSTAL-STRUCTURE

KW - DIVALENT LANTHANIDE CHEMISTRY

KW - RARE-EARTH-ELEMENTS

KW - ELECTRON-DENSITY

KW - STRUCTURAL-CHARACTERIZATION

KW - MOLECULAR-COMPLEXES

KW - SUPERBULKY LIGANDS

KW - OXIDATION-STATE

KW - BOND FORMATION

KW - BASIS-SETS

UR - http://www.scopus.com/inward/record.url?scp=85019645882&partnerID=8YFLogxK

U2 - 10.1021/acs.organomet.7b00014

DO - 10.1021/acs.organomet.7b00014

M3 - Article

AN - SCOPUS:85019645882

VL - 36

SP - 1287

EP - 1295

JO - Organometallics

JF - Organometallics

SN - 0276-7333

IS - 7

ER -

ID: 10191226