Publication

  1. Forbes, C. R.; Sudipta K. S.; Ganguly, H. K; Bai, S.*; Yap, G. P. A.*; Patel, S.;* Zondlo, N. J.*: Insights into Thiol-Aromatic Interacations:  A Stereoelectronic Basis for S–H/π Interactions, Journal of the American Chemical Society 2017 139, 1842-1855.  DOI: 1021/jacs.6b08415
  2. Gao, F.; Aminane, S.; Bai, S; Teplyakov, A. V.*: Chemical Protection of Material Morphology: Robust and Gentle Gas-Phase Surface Functionalization of ZnO with Propiolic Acid,   Chem. Mater. 2017, 29, 4063-4071. DOI: 10.1021/acs.chemmater.7b00747
  3. Holmes, S. T.; Bai, S.; Iuliucci, R. J.; Mueller, K. T.; Dybowski, C.*: Calculations of solid-state 43Ca NMR parameters: A comparison of periodic and cluster approaches and an evaluation of DFT functionals J. Comput. Chem. 2017, 38, 949-956.  doi: 10.1002/jcc.24763
  4. Bai, S. Nuclear Magnetic Resonance Instrumentation in Encyclopedia of Analytical Chemistry, eds R.A. Meyers, John Wiley: Chichester. DOI: 10.1002/9780470027318.a6108.pub3. Published June 15 2016.
  5. Yu, S.M.; Wu, J.F.; Liu, C.; Liu, W.; Bai, S; Huang, J.; Wang, W.*: Alkane Activation Initiated by Hydride Transfer: Co-conversion of Propane and Methanol over H-ZSM-5 Zeolite. Chem. Int. Ed. 2015, 54, 7363-7366.
  6. Taylor, R. E.; Beckmann, P. A.; Bai, S.; Dybowski, C.*: I-127 and Pb-207 Solid-State NMR Spectroscopy and Nuclear Spin Relaxation in PbI2: A Preliminary Study. J Phys Chem C 2014, 118, 9143-9153.
  7. An, W. K.; Han, M. Y.; Wang, C. A.; Yu, S. M.; Zhang, Y.; Bai, S.; Wang, W.*: Insights into the Asymmetric Heterogeneous Catalysis in Porous Organic Polymers: Construction A TADDOL-Embedded Chiral Catalyst for Studying the Structure-Activity Relationship. Eur. J. 2014, 20, 11.
  8. Wu, J. F.; Yu, S. M.; Wang, W. D.; Fan, Y. X.; Bai, S.; Zhang, C. W.; Gao, Q.; Huang, J.; Wang, W.*: Mechanistic insight into the formation of acetic acid from the direct conversion of methane and carbon dioxide on zinc-modified H-ZSM-5 zeolite. Journal of the American Chemical Society 2013, 135, 13567-73.
  9. Grieshaber, S. E.; Paik, B. A.; Bai, S.; Kiick, K. L.; Jia, X. Q.*: Nanoparticle formation from hybrid, multiblock copolymers of poly(acrylic acid) and a VPGVG peptide. Soft matter 2013, 9, 1589-1599.
  10. Wang, W. D.; Gao, X. D.; Strohmeier, M.; Wang, W.; Bai, S.*; Dybowski, C.: Solid-State NMR Studies of Form I of Atorvastatin Calcium. Journal of Physical Chemistry B 2012, 116, 3641-3649.
  11. Jin, X. L.; Wei, X.; Qi, F. M.; Yu, S. S.; Zhou, B.; Bai, S*.: Characterization of Hydroxycinnamic Acid Derivatives Binding to Bovine Serum Albumin. Organic & Biomolecular Chemsitry 2012, 10, 3424-3431.
  12. Grieshaber, S. E.; Farran, A. J.; Bai, S.; Kiick, K. L.; Jia, X.*: Tuning the properties of elastin mimetic hybrid copolymers via a modular polymerization method. Biomacromolecules 2012, 13, 1774-86.
  13. Bai, S.*: Nuclear Magnetic Resonance Instrumentation. In Encyclopedia of Analytical Chemsitry; Meyers, R. A., Ed.; John Wiley & Sons, Ltd. : Chichester, UK, 2012; pp 1498-1522.
  14. Wang, X. B.; Huang, J.; Xiang, S. L.; Liu, Y.; Zhang, J. Y.; Eichhofer, A.; Fenske, D.; Bai, S.; Su, C. Y.*: Discrete Ag6L6 coordination nanotubular structures based on a T-shaped pyridyl diphosphine. Chemical communications 2011, 47, 3849-3851.
  15. Taylor, R. E.*; Bai, S.; Dybowski, C.: A solid-state Hg-199 NMR study of mercury halides. Journal of Molecular Structure 2011, 987, 193-198.
  16. Glatfelter, A.; Bai, S.; Dmitrenko, O.; Perry, D. L.; Van Bramer, S. E.; Dybowski, C.*: Solid-state Pb-207 nuclear magnetic resonance studies of adducts of 1,10-phenanthroline with lead(II) halides. Canadian Journal of Chemistry-Revue Canadienne De Chimie 2011, 89, 863-869.
  17. Dong, Z. Z.; Bai, S.; Yap, G. P. A.; Fox, J. M.*: Interplay between the diamine structure and absolute helicity in Ni-salen metallofoldamers. Chemical communications 2011, 47, 3781-3783.
  18. Liu, W.; Wang, W. D.; Wang, W.; Bai, S.*; Dybowski, C.: Measurement of the principal values of the chemical-shift tensors of overlapping protonated and unprotonated carbons with the 2D-SUPER technique and dipolar dephasing (DD-SUPER). Journal of Magnetic Resonance 2010, 206, 177-181.
  19. Liu, W.; Wang, W. D.; Wang, W.; Bai, S.*; Dybowski, C.: Influence of Structure on the Spectroscopic Properties of the Polymorphs of Piroxicam. Journal of Physical Chemistry B 2010, 114, 16641-16649.
  20. Bai, S.; Wang, W.; Dybowski, C.*: Solid State NMR Spectroscopy. Analytical chemistry 2010, 82, 4917-4924.
  21. Bai, S.*; Dmitrenko, O.; Dybowski, C.: N-15 and C-13 NMR chemical shifts of 6-(fluoro, chloro, bromo, and iodo)purine 2 ‘-deoxynucleosides: measurements and calculations. Magnetic Resonance in Chemistry 2010, 48, 61-67.
  22. Yu, B. Z.; Kaimal, R.; Bai, S.; El Sayed, K. A.; Tatulian, S. A.; Apitz, R. J.; Jain, M. K.*; Deng, R. T.; Berg, O. G.: Effect of Guggulsterone and Cembranoids of Commiphora mukul on Pancreatic Phospholipase A(2): Role in Hypocholesterolemia. Journal of natural products 2009, 72, 24-28.
  23. Yu, B. Z.; Bai, S.; Berg, O. G.; Jain, M. K.*: Allosteric Effect of Amphiphile Binding to Phospholipase A(2). Biochemistry 2009, 48, 3219-3229.
  24. Taylor, R. E.; Carver, C. T.; Larsen, R. E.; Dmitrenko, O.; Bai, S.; Dybowski, C.*: Revisiting HgCl2: A solution- and solid-state Hg-199 NMR and ZORA-DFT computational study. Journal of Molecular Structure 2009, 930, 99-109.
  25. Neue, G.; Bai, S.; Taylor, R. E.; Beckmann, P. A.*; Vega, A. J.; Dybowski, C.: Sn-119 spin-lattice relaxation in alpha-SnF2. Physical Review B 2009, 79.
  26. Glatfelter, A.; Dybowski, C.*; Bai, S.; Kragten, D.; Blake, M. J.; Segarra, S.; Perry, D. L.: Infrared studies of lead(II) halide-1,10-phenanthroline photosensitive materials. Spectrochimica Acta Part a-Molecular and Biomolecular Spectroscopy 2009, 71, 1922-1926.
  27. Dmitrenko, O.; Bai, S.; Dybowski, C.*: Prediction of (207)Pb NMR parameters for the solid ionic lead(II) halides using the relativistic ZORA-DFT formalism: Comparison with the lead-containing molecular systems. Solid State Nuclear Magnetic Resonance 2008, 34, 186-190.
  28. Dmitrenko, O.; Bai, S.; Beckmann, P. A.; van Bramer, S.; Vega, A. J.; Dybowski, C.*: The relationship between Pb-207 NMR chemical shift and solid-state structure in Pb(II) compounds. Journal of Physical Chemistry A 2008, 112, 3046-3052.
  29. Bai, S.*; Jain, M. K.; Bergs, O. G.: Contiguous binding of decylsulfate on the interface-binding surface of pancreatic phospholipase A(2). Biochemistry 2008, 47, 2899-2907.
  30. Bai, S.*; Jain, M.: H-1 and C-13 assignments of five cembrenes from guggul. Magnetic Resonance in Chemistry 2008, 46, 791-793.
  31. Ye, Y. K.; Bai, S.; Vyas, S.; Wirth, M. J.*: NMR and computational studies of chiral discrimination by amylose tris(3,5-dimethylphenylcarbamate). Journal of Physical Chemistry B 2007, 111, 1189-1198.
  32. Ramadan, D.; Cline, D. J.; Bai, S.; Thorpe, C.*; Schneider, J. P.*: Effects of As(III) binding on beta-hairpin structure. Journal of the American Chemical Society 2007, 129, 2981-2988.
  33. Glatfelter, A.; Dybowski, C.*; Kragten, D. D.; Bai, S.; Perry, D. L.; Lockard, J.: Solid-state Pb-207 NMR studies of mixed lead halides, PbFX (X = Cl, Br, or I). Spectrochimica Acta Part a-Molecular and Biomolecular Spectroscopy 2007, 66, 1361-1363.
  34. Glatfelter, A.; Dybowski, C.*; Bai, S.; Peny, D. L.: Syntheses of photo-active lead(II)-1,10-phenanthroline materials. Materials Letters 2007, 61, 437-439.
  35. Vega, A. J.*; Beckmann, P. A.; Bai, S.; Dybowski, C.: Spin-lattice relaxation of heavy spin-1/2 nuclei in diamagnetic solids: A Raman process mediated by spin-rotation interaction. Physical Review B 2006, 74.
  36. Van Bramer, S. E.; Glatfelter, A.; Bai, S.; Dybowski, C.*; Neue, G.; Perry, D. L.: Solid-state Pb-207 NMR studies of lead-group 16 and mixed transition-metal/lead-group 16 element-containing materials. Magnetic Resonance in Chemistry 2006, 44, 357-365.
  37. Glatfelter, A.; Stephenson, N.; Bai, S.; Dybowski, C.*; Perry, D. L.: Quantitative determination of lead in mixtures of lead(II) halides using solid-state Pb-207 NMR spectroscopy. Analyst 2006, 131, 1207-1209.
  38. Dybowski, C.*; Bai, S.: Solid-state nuclear magnetic resonance. Analytical chemistry 2006, 78, 3853-3858.
  39. Dong, Z. Z.; Karpowicz, R. J.; Bai, S.; Yap, G. P. A.; Fox, J. M.*: Control of absolute helicity in single-stranded abiotic metallofoldamers. Journal of the American Chemical Society 2006, 128, 14242-14243.
  40. Beckmann, P. A.*; Bai, S.; Vega, A. J.; Dybowski, C.: Pb-207 spin-lattice relaxation in solid PbMoO4 and PbCl2. Physical Review B 2006, 74.
  41. Zhang, F.; Bai, S.; Yap, G. P. A.; Tarwade, V.; Fox, J. M.*: Abiotic metallofoldamers as electrochemically responsive molecules. Journal of the American Chemical Society 2005, 127, 10590-10599.
  42. Smith, J. M.; Dybowski, C.*; Bai, S.: Kinetics of NMR spin-lock polarization transfer in crystalline glycine and spin-lattice relaxation of amino acids. Solid State Nuclear Magnetic Resonance 2005, 27, 149-154.
  43. Beckmann, P. A.; Bai, S.; Dybowski, C.*: Cd-111 and Cd-113 spin-lattice relaxation in CdMoO4 by paramagnetic centers in the absence of spin diffusion. Physical Review B 2005, 71.
  44. Bai, S. P.; Zhu, Z. F.; Yang, L.: An ent-abietane diterpenoid from Doellingeria scaber. Acta Crystallographica Section E-Structure Reports Online 2005, 61, O2853-O2855.
  45. Dybowski, C.*; Bai, S.; van Bramer, S.: Solid-state nuclear magnetic resonance. Analytical chemistry 2004, 76, 3263-3267.
  46. Van Bramer, S. E.; Glatfelter, A.; Bai, S.; Dybowski, C.*; Neue, G.: Data acquisition and analysis of broad chemical-shift powder patterns from solids with spin-echo techniques. Concepts in Magnetic Resonance 2002, 14, 365-387.
  47. Dybowski, C.*; Bai, S.; Van Bramer, S.: Solid-state nuclear magnetic resonance. Analytical chemistry 2002, 74, 2713-2718.
  48. Wind, R. A.*; Bai, S.; Hu, J. Z.; Solum, M. S.; Ellis, P. D.; Grant, D. M.*; Pugmire, R. J.; Taylor, C. M. V.; Yonker, C. R.: H-1 dynamic nuclear polarization in supercritical ethylene at 1.4 T. Journal of Magnetic Resonance 2000, 143, 233-239.
  49. Orendt, A. M.; Facelli, J. C.; Bai, S.; Rai, A.; Gossett, M.; Scott, L. T.; Boerio-Goates, J.; Pugmire, R. J.; Grant, D. M.*: Carbon-13 shift tensors in polycyclic aromatic compounds. 8. A low-temperature NMR study of coronene and corannulene. Journal of Physical Chemistry A 2000, 104, 149-155.
  50. Hu, J. Z.; Wang, W.; Bai, S.; Pugmire, R. J.; Taylor, C. M. V.; Grant, D. M.*: Investigation of polyethylene by means of magic angle turning and separated-local-field experiments. Macromolecules 2000, 33, 3359-3367.
  51. Dybowski, C.*; Bai, S.: Solid state nuclear magnetic resonance. Analytical chemistry 2000, 72, 1R-7R.
  52. Altounian, N.; Glatfelter, A.; Bai, S.; Dybowski, C.*: Thermodynamics of ion pairing in lead nitrate solutions as determined with Pb-207 NMR spectroscopy. Journal of Physical Chemistry B 2000, 104, 4723-4725.
  53. Bai, S.; Hu, J. Z.; Pugmire, R. J.; Grant, D. M.*; Taylor, C. M. V.; Rubin, J. B.; Peterson, E. J.: Solid state NMR and wide angle X-ray diffraction studies of supercritical fluid CO2-treated poly(ethylene terephthalate). Macromolecules 1998, 31, 9238-9246.
  54. Taylor, C. M. V.; Bai, S.; Mayne, C. L.; Grant, D. M.*: Hydrogen bonding of methanol in supercritical CO2 studied by C-13 nuclear spin-lattice relaxation. Journal of Physical Chemistry B 1997, 101, 5652-5658.
  55. Bai, S.; Taylor, C. M. V.; Liu, F.; Mayne, C. L.; Pugmire, R. J.; Grant, D. M.*: CO2 clustering of 1-decanol and methanol in supercritical fluids by C-13 nuclear spin-lattice relaxation. Journal of Physical Chemistry B 1997, 101, 2923-2928.
  56. Bai, S.; Taylor, C. M.; Mayne, C. L.; Pugmire, R. J.; Grant, D. M.*: A new high pressure sapphire nuclear magnetic resonance cell. Review of Scientific Instruments 1996, 67, 240-243.
  57. Bai, S.; Mayne, C. L.; Pugmire, R. J.; Grant, D. M.: Fluid structures of CO2 and CO2-CH4 mixture at supercritical fluid and liquid densities by nuclear spin-lattice relaxation measurements. Magnetic Resonance in Chemistry 1996, 34, 479-488.
  58. Bai, S.; Pugmire, R. J.; Mayne, C. L.; Grant, D. M.*: C-13 NMR Determination of Protonated and Nonprotonated Carbons in Model Compounds, Mixtures, and Coal-Derived Liquid Samples. Analytical chemistry 1995, 67, 3433-3440.
  59. Fletcher, T. H.; Bai, S.; Pugmire, R. J.; Solum, M. S.; Wood, S.; Grant, D. M.*: Chemical Structural Features of Pyridine Extracts and Residues of the Argonne Premium Coals Using Solid-State C-13 NMRr-Spectroscopy. Energy & Fuels 1993, 7, 734-742.
  60. Bai, S.; Chen, M. Z.; Chen, W. F.; Zheng, G. K.*: A Thermodynamic Study on Self-Association of Some Aliphatic Amines by Freezing Point Depression. Acta Physico-Chimica Sinica 1990, 6, 62-70.