Measuring molecular parity nonconservation using nuclear-magnetic-resonance spectroscopy
Abstract
Here, the weak interaction does not conserve parity and therefore induces energy shifts in chiral enantiomers that should in principle be detectable in molecular spectra. Unfortunately, the magnitude of the expected shifts are small and in spectra of a mixture of enantiomers, the energy shifts are not resolvable. We propose a nuclear-magnetic-resonance (NMR) experiment in which we titrate the chirality (enantiomeric excess) of a solvent and measure the diasteriomeric splitting in the spectra of a chiral solute in order to search for an anomalous offset due to parity nonconservation (PNC). We present a proof-of-principle experiment in which we search for PNC in the 13C resonances of small molecules, and use the 1H resonances, which are insensitive to PNC, as an internal reference. We set a constraint on molecular PNC in 13C chemical shifts at a level of 10–5 ppm, and provide a discussion of important considerations in the search for molecular PNC using NMR spectroscopy.
- Authors:
-
- Univ. of Southampton, Southampton (United Kingdom); Johannes Gutenberg-Univ. Mainz, Mainz (Germany)
- Helmholtz-Institut Mainz, Mainz (Germany)
- Johannes Gutenberg-Univ. Mainz, Mainz (Germany)
- Petersburg Nuclear Physics Institute, Gatchina (Russia); St. Petersburg Electrotechnical Univ. LETI, St. Petersburg (Russia)
- Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States); Univ. of California, Berkeley, CA (United States)
- Johannes Gutenberg-Univ. Mainz, Mainz (Germany); Helmholtz-Institut Mainz, Mainz (Germany); Univ. of California, Berkeley, CA (United States); Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States)
- Publication Date:
- Research Org.:
- Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States)
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES)
- OSTI Identifier:
- 1421838
- Alternate Identifier(s):
- OSTI ID: 1405554
- Grant/Contract Number:
- AC02-05CH11231
- Resource Type:
- Accepted Manuscript
- Journal Name:
- Physical Review A
- Additional Journal Information:
- Journal Volume: 96; Journal Issue: 4; Journal ID: ISSN 2469-9926
- Publisher:
- American Physical Society (APS)
- Country of Publication:
- United States
- Language:
- English
- Subject:
- 74 ATOMIC AND MOLECULAR PHYSICS
Citation Formats
Eills, J., Blanchard, J. W., Bougas, L., Kozlov, M. G., Pines, A., and Budker, D. Measuring molecular parity nonconservation using nuclear-magnetic-resonance spectroscopy. United States: N. p., 2017.
Web. doi:10.1103/PhysRevA.96.042119.
Eills, J., Blanchard, J. W., Bougas, L., Kozlov, M. G., Pines, A., & Budker, D. Measuring molecular parity nonconservation using nuclear-magnetic-resonance spectroscopy. United States. https://doi.org/10.1103/PhysRevA.96.042119
Eills, J., Blanchard, J. W., Bougas, L., Kozlov, M. G., Pines, A., and Budker, D. Mon .
"Measuring molecular parity nonconservation using nuclear-magnetic-resonance spectroscopy". United States. https://doi.org/10.1103/PhysRevA.96.042119. https://www.osti.gov/servlets/purl/1421838.
@article{osti_1421838,
title = {Measuring molecular parity nonconservation using nuclear-magnetic-resonance spectroscopy},
author = {Eills, J. and Blanchard, J. W. and Bougas, L. and Kozlov, M. G. and Pines, A. and Budker, D.},
abstractNote = {Here, the weak interaction does not conserve parity and therefore induces energy shifts in chiral enantiomers that should in principle be detectable in molecular spectra. Unfortunately, the magnitude of the expected shifts are small and in spectra of a mixture of enantiomers, the energy shifts are not resolvable. We propose a nuclear-magnetic-resonance (NMR) experiment in which we titrate the chirality (enantiomeric excess) of a solvent and measure the diasteriomeric splitting in the spectra of a chiral solute in order to search for an anomalous offset due to parity nonconservation (PNC). We present a proof-of-principle experiment in which we search for PNC in the 13C resonances of small molecules, and use the 1H resonances, which are insensitive to PNC, as an internal reference. We set a constraint on molecular PNC in 13C chemical shifts at a level of 10–5 ppm, and provide a discussion of important considerations in the search for molecular PNC using NMR spectroscopy.},
doi = {10.1103/PhysRevA.96.042119},
journal = {Physical Review A},
number = 4,
volume = 96,
place = {United States},
year = {Mon Oct 30 00:00:00 EDT 2017},
month = {Mon Oct 30 00:00:00 EDT 2017}
}
Web of Science
Works referenced in this record:
Search for Resolution of Chiral Fluorohalogenomethanes and Parity-Violation Effects at the Molecular Level
journal, June 2003
- Crassous, Jeanne; Monier, Franck; Dutasta, Jean-Pierre
- ChemPhysChem, Vol. 4, Issue 6
Investigation of DOTA-Metal Chelation Effects on the Chemical Shift of 129 Xe
journal, October 2015
- Jeong, Keunhong; Slack, Clancy C.; Vassiliou, Christophoros C.
- ChemPhysChem, Vol. 16, Issue 17
Parity nonconservation contribution to the nuclear magnetic resonance shielding constants of chiral molecules: A four-component relativistic study
journal, August 2006
- Bast, Radovan; Schwerdtfeger, Peter; Saue, Trond
- The Journal of Chemical Physics, Vol. 125, Issue 6
NMR and parity nonconservation. Experimental requirements to observe a difference between enantiomer signals
journal, January 2001
- Robert, J. -B.; Barra, A. L.
- Chirality, Vol. 13, Issue 10
Violations of fundamental symmetries in atoms and tests of unification theories of elementary particles
journal, July 2004
- Ginges, J. S. M.; Flambaum, V. V.
- Physics Reports, Vol. 397, Issue 2
Parity violation in atoms
journal, November 1997
- Bouchiat, Marie-Anne; Bouchiat, Claude
- Reports on Progress in Physics, Vol. 60, Issue 11
Parity-violating contributions to nuclear magnetic shielding
journal, September 2003
- Soncini, Alessandro; Faglioni, Francesco; Lazzeretti, Paolo
- Physical Review A, Vol. 68, Issue 3
Limiting -Odd Interactions of Cosmic Fields with Electrons, Protons, and Neutrons
journal, August 2014
- Roberts, B. M.; Stadnik, Y. V.; Dzuba, V. A.
- Physical Review Letters, Vol. 113, Issue 8
Combined high resolution infrared and microwave study of bromochlorofluoromethane
journal, May 1997
- Bauder, Alfred; Beil, Andreas; Luckhaus, David
- The Journal of Chemical Physics, Vol. 106, Issue 18
Zeeman-Tuned Rotational Level-Crossing Spectroscopy in a Diatomic Free Radical
journal, April 2014
- Cahn, S. B.; Ammon, J.; Kirilov, E.
- Physical Review Letters, Vol. 112, Issue 16
Chiral reagents for the determination of enantiomeric excess and absolute configuration using NMR spectroscopy
journal, January 2003
- Wenzel, Thomas J.; Wilcox, James D.
- Chirality, Vol. 15, Issue 3
Alignment of Biopolymers in Strained Gels: A New Way To Create Detectable Dipole−Dipole Couplings in High-Resolution Biomolecular NMR
journal, September 2000
- Tycko, Robert; Blanco, Francisco J.; Ishii, Yoshitaka
- Journal of the American Chemical Society, Vol. 122, Issue 38
Observations of the Failure of Conservation of Parity and Charge Conjugation in Meson Decays: the Magnetic Moment of the Free Muon
journal, February 1957
- Garwin, Richard L.; Lederman, Leon M.; Weinrich, Marcel
- Physical Review, Vol. 105, Issue 4
Question of Parity Conservation in Weak Interactions
journal, October 1956
- Lee, T. D.; Yang, C. N.
- Physical Review, Vol. 104, Issue 1
Experimental Test of Parity Conservation in Beta Decay
journal, February 1957
- Wu, C. S.; Ambler, E.; Hayward, R. W.
- Physical Review, Vol. 105, Issue 4
Increase in signal-to-noise ratio of > 10,000 times in liquid-state NMR
journal, August 2003
- Ardenkjaer-Larsen, J. H.; Fridlund, B.; Gram, A.
- Proceedings of the National Academy of Sciences, Vol. 100, Issue 18
Using Molecules to Measure Nuclear Spin-Dependent Parity Violation
journal, January 2008
- DeMille, D.; Cahn, S. B.; Murphree, D.
- Physical Review Letters, Vol. 100, Issue 2
High-Resolution Spectroscopic Studies and Theory of Parity Violation in Chiral Molecules
journal, May 2008
- Quack, Martin; Stohner, Jürgen; Willeke, Martin
- Annual Review of Physical Chemistry, Vol. 59, Issue 1
Perturbational calculations of parity-violating effects in nuclear-magnetic-resonance parameters
journal, August 2005
- Weijo, Ville; Manninen, Pekka; Vaara, Juha
- The Journal of Chemical Physics, Vol. 123, Issue 5
Possible Observation of Parity Nonconservation by High-Resolution NMR
journal, February 1988
- Barra, A. L.; Robert, J. B.; Wiesenfeld, L.
- Europhysics Letters (EPL), Vol. 5, Issue 3
Ab Initio Calculation of Parity-Violating Chemical Shifts in NMR Spectra of Chiral Molecules
journal, April 2003
- Laubender, Guido; Berger, Robert
- ChemPhysChem, Vol. 4, Issue 4
Narrow resonances of saturated absorption of the asymmetrical molecule CHFCiBr and the possibility of weak current detection in molecular physics
journal, December 1976
- Kompanets, O. N.; Kukudzhanov, A. R.; Letokhov, V. S.
- Optics Communications, Vol. 19, Issue 3
A proposed experiment to measure the parity-violating energy difference between enantiomers from the optical rotation of chiral ammonia-like “cat” molecules
journal, October 2004
- MacDermott, A. J.; Hegstrom, R. A.
- Chemical Physics, Vol. 305, Issue 1-3
Nonequivalence of the nuclear magnetic resonance spectra of enantiomers in optically active solvents. IV. Assignment of absolute configuration
journal, October 1967
- Pirkle, William H.; Beare, Steven D.
- Journal of the American Chemical Society, Vol. 89, Issue 21
Reversible Interactions with para-Hydrogen Enhance NMR Sensitivity by Polarization Transfer
journal, March 2009
- Adams, R. W.; Aguilar, J. A.; Atkinson, K. D.
- Science, Vol. 323, Issue 5922
Parahydrogen and synthesis allow dramatically enhanced nuclear alignment
journal, September 1987
- Bowers, C. Russell; Weitekamp, D. P.
- Journal of the American Chemical Society, Vol. 109, Issue 18
Using signal amplification by reversible exchange (SABRE) to hyperpolarise 119 Sn and 29 Si NMR nuclei
journal, January 2016
- Olaru, Alexandra M.; Burt, Alister; Rayner, Peter J.
- Chemical Communications, Vol. 52, Issue 100
A hyperpolarized equilibrium for magnetic resonance
journal, December 2013
- Hövener, Jan-Bernd; Schwaderlapp, Niels; Lickert, Thomas
- Nature Communications, Vol. 4, Issue 1
Parity-violating interactions of cosmic fields with atoms, molecules, and nuclei: Concepts and calculations for laboratory searches and extracting limits
journal, November 2014
- Roberts, B. M.; Stadnik, Y. V.; Dzuba, V. A.
- Physical Review D, Vol. 90, Issue 9
Molecular polarization and molecular chiralization: The first example of a chiralized xenon atom
journal, January 2000
- Bartik, Kristin; Luhmer, Michel; Collet, Andr�
- Chirality, Vol. 13, Issue 1
Chiral Recognition by Dissolution DNP NMR Spectroscopy of 13 C-Labeled dl -Methionine
journal, April 2017
- Monteagudo, Eva; Virgili, Albert; Parella, Teodor
- Analytical Chemistry, Vol. 89, Issue 9
Parity non-conservation and NMR observables. calculation of Tl resonance frequency differences in enantiomers
journal, May 1986
- Barra, A. L.; Robert, J. B.; Wiesenfeld, L.
- Physics Letters A, Vol. 115, Issue 9
Progress toward the first observation of parity violation in chiral molecules by high-resolution laser spectroscopy
journal, September 2010
- Darquié, Benoît; Stoeffler, Clara; Shelkovnikov, Alexander
- Chirality, Vol. 22, Issue 10
Parity violation in nuclear magnetic resonance frequencies of chiral tetrahedral tungsten complexes NWXYZ (X, Y, Z = H, F, Cl, Br or I)
journal, January 2014
- Nahrwold, Sophie; Berger, Robert; Schwerdtfeger, Peter
- The Journal of Chemical Physics, Vol. 140, Issue 2
Demonstration of the parity-violating energy difference between enantiomers
journal, April 1999
- Szabo-Nagy, A.; Keszthelyi, L.
- Proceedings of the National Academy of Sciences, Vol. 96, Issue 8
Para-hydrogen raser delivers sub-millihertz resolution in nuclear magnetic resonance
journal, March 2017
- Suefke, Martin; Lehmkuhl, Sören; Liebisch, Alexander
- Nature Physics, Vol. 13, Issue 6
Search for a Parity-Violating Energy Difference between Enantiomers of a Chiral Iron Complex
journal, November 2000
- Lahamer, A. S.; Mahurin, S. M.; Compton, R. N.
- Physical Review Letters, Vol. 85, Issue 21
Diastereomeric Xe Chemical Shifts in Tethered Cryptophane Cages
journal, December 2006
- Ruiz, E. Janette; Sears, Devin N.; Pines, Alexander
- Journal of the American Chemical Society, Vol. 128, Issue 51
Works referencing / citing this record:
High-precision methanol spectroscopy with a widely tunable SI-traceable frequency-comb-based mid-infrared QCL
journal, January 2019
- Santagata, R.; Tran, D. B. A.; Argence, B.
- Optica, Vol. 6, Issue 4