Two-point contact chiral distinction—a theoretical appraisal

T. P. Radhakrishnan; Sid Topiol; P. Ulrich Biedermann; Sarit Garten; Israel Agranat

doi:10.1039/b205346b

Two-point contact chiral distinction—a theoretical appraisal

T. P. Radhakrishnan^*, Sid Topiol, P. Ulrich Biedermann, Sarit Garten, Israel Agranat

^*Corresponding author for this work

Institute of Chemistry

Research output: Contribution to journal › Article › peer-review

12 Scopus citations

Abstract

Ab initio calculations reveal chiral distinction in two-point contact CHFClBr dimers, with chiral distinction energy of 1.5 kJ mol^-1between the SR and SS dimers fully optimized at the MP2/6-311++G** level.

Original language	English
Pages (from-to)	2664-2665
Number of pages	2
Journal	Chemical Communications
Volume	2
Issue number	22
DOIs	https://doi.org/10.1039/b205346b
State	Published - 2002

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@article{8a039ef0ed334d33bbbc69f353888587,

title = "Two-point contact chiral distinction—a theoretical appraisal",

abstract = "Ab initio calculations reveal chiral distinction in two-point contact CHFClBr dimers, with chiral distinction energy of 1.5 kJ mol-1between the SR and SS dimers fully optimized at the MP2/6-311++G** level.",

author = "Radhakrishnan, {T. P.} and Sid Topiol and Biedermann, {P. Ulrich} and Sarit Garten and Israel Agranat",

year = "2002",

doi = "10.1039/b205346b",

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AU - Radhakrishnan, T. P.

AU - Topiol, Sid

AU - Biedermann, P. Ulrich

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AU - Agranat, Israel

PY - 2002

Y1 - 2002

N2 - Ab initio calculations reveal chiral distinction in two-point contact CHFClBr dimers, with chiral distinction energy of 1.5 kJ mol-1between the SR and SS dimers fully optimized at the MP2/6-311++G** level.

AB - Ab initio calculations reveal chiral distinction in two-point contact CHFClBr dimers, with chiral distinction energy of 1.5 kJ mol-1between the SR and SS dimers fully optimized at the MP2/6-311++G** level.

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VL - 2

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JO - Chemical Communications

JF - Chemical Communications

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ER -

Two-point contact chiral distinction—a theoretical appraisal

Abstract

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