Formation of a σ-alkane Complex and a Molecular Rearrangement in the Solid-State: [Rh(Cyp2PCH2CH2PCyp2)(η2:η2-C7H12)][BArF4]

Alasdair I. McKay; Tobias Krämer; Nicholas H. Rees; Amber L.  Thompson; Kirsten E. Christensen; Stuart Alan Macgregor; Andrew S Weller

doi:10.1021/acs.organomet.6b00645

Formation of a σ-alkane Complex and a Molecular Rearrangement in the Solid-State: [Rh(Cyp2PCH2CH2PCyp2)(η2:η2-C7H12)][BArF4]

Alasdair I. McKay, Tobias Krämer, Nicholas H. Rees, Amber L. Thompson, Kirsten E. Christensen, Stuart Alan Macgregor, Andrew S Weller

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Abstract

Addition of H2 to the precursor [Rh(Cyp2PCH2CH2PCyp2)(η2:η2-C7H8)][BArF4] gives the σ-alkane complex [Rh(Cyp2PCH2CH2PCyp2)(η2:η2-C7H12)][BArF4] by a single-crystal to single-crystal reaction, as characterized by X-ray crystallography, SSNMR spectroscopy, and periodic DFT. An unexpected rearrangement of the {Rh(L2)}+ fragment is revealed.

Original language	English
Journal	Organometallics
Early online date	23 Sept 2016
DOIs	https://doi.org/10.1021/acs.organomet.6b00645
Publication status	E-pub ahead of print - 23 Sept 2016

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title = "Formation of a σ-alkane Complex and a Molecular Rearrangement in the Solid-State: [Rh(Cyp2PCH2CH2PCyp2)(η2:η2-C7H12)][BArF4]",

abstract = "Addition of H2 to the precursor [Rh(Cyp2PCH2CH2PCyp2)(η2:η2-C7H8)][BArF4] gives the σ-alkane complex [Rh(Cyp2PCH2CH2PCyp2)(η2:η2-C7H12)][BArF4] by a single-crystal to single-crystal reaction, as characterized by X-ray crystallography, SSNMR spectroscopy, and periodic DFT. An unexpected rearrangement of the {Rh(L2)}+ fragment is revealed.",

author = "McKay, {Alasdair I.} and Tobias Kr{\"a}mer and Rees, {Nicholas H.} and Thompson, {Amber L.} and Christensen, {Kirsten E.} and Macgregor, {Stuart Alan} and Weller, {Andrew S}",

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doi = "10.1021/acs.organomet.6b00645",

language = "English",

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T1 - Formation of a σ-alkane Complex and a Molecular Rearrangement in the Solid-State: [Rh(Cyp2PCH2CH2PCyp2)(η2:η2-C7H12)][BArF4]

AU - McKay, Alasdair I.

AU - Krämer, Tobias

AU - Rees, Nicholas H.

AU - Thompson, Amber L.

AU - Christensen, Kirsten E.

AU - Macgregor, Stuart Alan

AU - Weller, Andrew S

PY - 2016/9/23

Y1 - 2016/9/23

N2 - Addition of H2 to the precursor [Rh(Cyp2PCH2CH2PCyp2)(η2:η2-C7H8)][BArF4] gives the σ-alkane complex [Rh(Cyp2PCH2CH2PCyp2)(η2:η2-C7H12)][BArF4] by a single-crystal to single-crystal reaction, as characterized by X-ray crystallography, SSNMR spectroscopy, and periodic DFT. An unexpected rearrangement of the {Rh(L2)}+ fragment is revealed.

AB - Addition of H2 to the precursor [Rh(Cyp2PCH2CH2PCyp2)(η2:η2-C7H8)][BArF4] gives the σ-alkane complex [Rh(Cyp2PCH2CH2PCyp2)(η2:η2-C7H12)][BArF4] by a single-crystal to single-crystal reaction, as characterized by X-ray crystallography, SSNMR spectroscopy, and periodic DFT. An unexpected rearrangement of the {Rh(L2)}+ fragment is revealed.

U2 - 10.1021/acs.organomet.6b00645

DO - 10.1021/acs.organomet.6b00645

M3 - Article

SN - 0276-7333

JO - Organometallics

JF - Organometallics

ER -

Formation of a σ-alkane Complex and a Molecular Rearrangement in the Solid-State: [Rh(Cyp2PCH2CH2PCyp2)(η2:η2-C7H12)][BArF4]

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