A Donor-Functionalized, Silyl-Substituted Pentadienyllithium: Structural Insight from Experiment and Theory

S.A. Solomon; F.M. Bickelhaupt; R.A. Layfield; M. Nilsson; J. Poater; M. Solà

doi:10.1039/c1cc11697e

A Donor-Functionalized, Silyl-Substituted Pentadienyllithium: Structural Insight from Experiment and Theory

S.A. Solomon, F.M. Bickelhaupt, R.A. Layfield, M. Nilsson, J. Poater, M. Solà

Research output: Contribution to Journal › Article › Academic › peer-review

Abstract

A donor-functionalized, silyl-substituted pentadienyllithium has been synthesized and characterized by crystallography and NMR spectroscopy. The pentadienyl negative charge was found to be partially localized, which DFT revealed to be due to the polarizing power of the lithium cation. © 2011 The Royal Society of Chemistry.

Original language	English
Pages (from-to)	6162-6164
Journal	Chemical Commununications
Volume	47
DOIs	https://doi.org/10.1039/c1cc11697e
Publication status	Published - 2011

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CCDC 805551: Experimental Crystal Structure Determination
Solomon, S. A. (Contributor), Bickelhaupt, M. (Contributor), Layfield, R. A. (Contributor), Nilsson, M. (Contributor), Poater, J. (Contributor) & Sola, M. (Contributor), Unknown Publisher, 7 Jun 2011
DOI: 10.5517/ccw17jn, http://www.ccdc.cam.ac.uk/services/structure_request?id=doi:10.5517/ccw17jn&sid=DataCite
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title = "A Donor-Functionalized, Silyl-Substituted Pentadienyllithium: Structural Insight from Experiment and Theory",

abstract = "A donor-functionalized, silyl-substituted pentadienyllithium has been synthesized and characterized by crystallography and NMR spectroscopy. The pentadienyl negative charge was found to be partially localized, which DFT revealed to be due to the polarizing power of the lithium cation. {\textcopyright} 2011 The Royal Society of Chemistry.",

author = "S.A. Solomon and F.M. Bickelhaupt and R.A. Layfield and M. Nilsson and J. Poater and M. Sol{\`a}",

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language = "English",

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AU - Solomon, S.A.

AU - Bickelhaupt, F.M.

AU - Layfield, R.A.

AU - Nilsson, M.

AU - Poater, J.

AU - Solà, M.

PY - 2011

Y1 - 2011

N2 - A donor-functionalized, silyl-substituted pentadienyllithium has been synthesized and characterized by crystallography and NMR spectroscopy. The pentadienyl negative charge was found to be partially localized, which DFT revealed to be due to the polarizing power of the lithium cation. © 2011 The Royal Society of Chemistry.

AB - A donor-functionalized, silyl-substituted pentadienyllithium has been synthesized and characterized by crystallography and NMR spectroscopy. The pentadienyl negative charge was found to be partially localized, which DFT revealed to be due to the polarizing power of the lithium cation. © 2011 The Royal Society of Chemistry.

U2 - 10.1039/c1cc11697e

DO - 10.1039/c1cc11697e

M3 - Article

SN - 1359-7345

VL - 47

SP - 6162

EP - 6164

JO - Chemical Commununications

JF - Chemical Commununications

ER -

A Donor-Functionalized, Silyl-Substituted Pentadienyllithium: Structural Insight from Experiment and Theory

Abstract

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CCDC 805551: Experimental Crystal Structure Determination

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