1 MA. Plenary Monday, June 20, 2016 – 8:30 AM Room: Foellinger Auditorium Chair: Gregory S. Girolami, University of Illinois at Urbana-Champaign, Urbana, IL, USA Welcome 8:30 Barbara J. Wilson, Chancellor University of Illinois at Urbana-Champaign MA01 8:40 – 9:20 ELECTRONIC SPECTROSCOPY OF ORGANIC CATIONS IN GAS-PHASE AT 6 K: + IDENTIFICATION OF C60 IN THE INTERSTELLAR MEDIUM , John P. Maier MA02 9:25 – 10:05 SOME COMPLEX PRESSURE EFFECTS ON SPECTRA FROM SIMPLE CLASSICAL MECHANICS, Jean-Michel Hartmann Intermission MA03 10:35 – 11:15 MOLECULAR SPECTROSCOPY OF LIVING SYSTEMS, Ji-Xin Cheng MA04 11:20 – 12:00 OPTICAL AND MICROWAVE SPECTROSCOPY OF TRANSIENT METAL-CONTAINING MOLECULES, Timothy Steimle 2 MF. Mini-symposium: Spectroscopy of Large Amplitude Motions Monday, June 20, 2016 – 1:30 PM Room: 100 Noyes Laboratory Chair: Isabelle Kleiner, CNRS et Universites´ Paris Est et Paris Diderot, Creteil,´ France MF01 INVITED TALK 1:30 – 2:00 ON THE LOWEST RO-VIBRATIONAL STATES OF PROTONATED METHANE: EXPERIMENT AND ANALYTICAL MODEL , Hanno Schmiedt, Per Jensen, Oskar Asvany, Stephan Schlemmer MF02 2:05 – 2:20 SYMMETRY IN THE GENERALIZED ROTOR MODEL FOR EXTREMELY FLOPPY MOLECULES, Hanno Schmiedt, Per Jensen, Stephan Schlemmer MF03 2:22 – 2:37 + AN EFFECTIVE-HAMILTONIAN APPROACH TO CH5 , USING IDEAS FROM ATOMIC SPECTROSCOPY, Jon T. Hougen MF04 2:39 – 2:54 IMPACT OF ENERGETICALLY ACCESSIBLE PROTON PERMUTATIONS IN THE SPECTROSCOPY AND DYNAM- + ICS OF H5 , Zhou Lin, Anne B McCoy MF05 2:56 – 3:11 − VARIATION OF CH STRETCH FREQUENCIES WITH CH4 ORIENTATION IN THE CH4 F COMPLEX: MULTI- PLE RESONANCES AS VIBRATIONAL CONICAL INTERSECTIONS, Bishnu P. Thapaliya,− David S. Perry MF06 3:13 – 3:28 SADDLE POINT LOCALIZATION OF MOLECULAR WAVEFUNCTIONS, Georg Ch. Mellau, Aleksandra Kyuberis, Oleg Polyansky, Nikolay Fedorovich Zobov, Robert W Field Intermission MF07 3:47 – 4:02 SPECTROSCOPIC CHARACTERIZATION OF ISOMERIZATION TRANSITION STATES, Joshua H Baraban, Bryan Changala, Georg Ch. Mellau, John F. Stanton, Anthony Merer, Robert W Field MF08 4:04 – 4:19 ELECTRON ANISOTROPY AS A SIGNATURE OF MODE SPECIFIC ISOMERIZATION IN VINYLIDENEa, Stephen T Gibson, Benjamin A Laws, Richard Mabbs, Daniel Neumark, Carl Lineberger, Robert W Field aResearch supported by the Australian Research Council Discovery Project Grant DP160102585. MF09 4:21 – 4:36 OBSERVING QUANTUM MONODROMY: AN ENERGY-MOMENTUM MAP BUILT FROM EXPERIMENTALLY- DETERMINED LEVEL ENERGIES OBTAINED FROM THE ν7 FAR-INFRARED BAND SYSTEM OF NCNCS, Dennis W. Tokaryk, Stephen Cary Ross, Brenda P. Winnewisser, Manfred Winnewisser, Frank C. De Lucia, Brant E. Billinghurst MF10 4:38 – 4:53 + + SPECTROSCOPY OF H2 AND HD NEAR THE DISSOCIATION THRESHOLD: SHAPE AND FESHBACH RESO- NANCES, Maximilian Beyer, Frederic Merkt MF11 4:55 – 5:10 A DIATOMIC MOLECULE WITH EXTREMELY LARGE AMPLITUDE MOTION IN ITS VIBRATIONAL STATES THAT HAVE LENGTHS OF AT LEAST 12,000 ANGSTROMS. , Nikesh S. Dattani MF12 5:12 – 5:27 FIT POINT-WISE AB INITIO CALCULATION POTENTIAL ENERGIES TO A MULTI-DIMENSION MORSE/LONG- RANGE MODEL, Yu Zhai, Hui Li, Robert J. Le Roy 3 MG. Mini-symposium: Spectroscopy in Atmospheric Chemistry Monday, June 20, 2016 – 1:30 PM Room: 116 Roger Adams Lab Chair: Frank Keutsch, Harvard University, Cambridge, MA, USA MG01 INVITED TALK 1:30 – 2:00 MAPPING THE WORLD’S LARGEST NATURAL GAS LEAK AND OTHER METHANE SOURCES USING HIGH RESOLUTION SPECTROSCOPY, Stanley P. Sander, Clare Wong, Thomas J Pongetti MG02 2:05 – 2:20 THE ATMOSPHERIC CHEMISTRY EXPERIMENT (ACE): CO, CH4 AND N2O ISOTOPOLOGUES, Peter F. Bernath, Eric M. Buzan, Christopher A. Beale, Mahdi Yousefi, Chris Boone MG03 2:22 – 2:37 14 OPTICAL MEASUREMENTS OF CO2 USING CAVITY RING-DOWN SPECTROSCOPY, David A. Long, Adam J. Fleisher, Qingnan Liu, Joseph Hodges MG04 2:39 – 2:54 MID-IR CAVITY RINGDOWN SPECTROSCOPY MEASUREMENTS OF ATMOSPHERIC ETHANE TO METHANE RATIO, Linhan Shen, Thinh Quoc Bui, Lance Christensen, Mitchio Okumura MG05 2:56 – 3:11 MEASUREMENTS DOUBLY-SUBSTITUTED METHANE ISOTOPOLOGUE (13CH3D AND 12CH2D2) ABUDANCE USING FREQUENCY STABILIZED MID-IR CAVITY RINGDOWN SPECTROSCOPY, Linhan Shen, Thinh Quoc Bui, Mitchio Okumura MG06 3:13 – 3:28 THE NEAR-IR SPECTRUM OF CH3D, Shaoyue Yang, Kevin Lehmann, Robert J. Hargreaves, Peter F. Bernath, Michael Rey, Andrei V. Nikitin, Vladimir Tyuterev MG07 3:30 – 3:45 3µm - 1.6µm DOUBLE RESONANCE SPECTROSCOPY OF CH4, George Schwartz, Erik Belaas, Shaoyue Yang, Kevin Lehmann Intermission MG08 4:04 – 4:19 12 GLOBAL ANALYSIS OF THE HIGH TEMPERATURE INFRARED EMISSION SPECTRUM OF CH4 IN THE DYAD (ν2/ν4) REGION, Badr Amyay, Maud Louviot, Olivier Pirali, Robert Georges, Jean Vander Auwera, Vincent Boudon MG09 4:21 – 4:36 GLOBAL ANALYSIS OF SEVERAL BANDS OF THE CF4 MOLECULE, Mickael¨ Carlos, Oceane´ Gruson, Vincent Boudon, Robert Georges, Olivier Pirali, Pierre Asselin MG10 4:38 – 4:53 HIGH RESOLUTION FAR INFRARED SPECTROSCOPY OF HFC-134a AT COLD TEMPERATURES, Andy Wong, Chris Medcraft, Christopher Thompson, Evan Gary Robertson, Dominique Appadoo, Don McNaughton MG11 4:55 – 5:10 ON THE USE OF DIFFERENCE BANDS FOR MODELING SF6 ABSORPTION IN THE 10µm ATMOSPHERIC WIN- DOW, Mbaye Faye, Laurent Manceron, P. Roy, Vincent Boudon, Michel Loete MG12 5:12 – 5:27 POSSIBLE MECHANISM FOR SULFUR MASS INDEPENDENT FRACTIONATION IN THE B-X UV TRANSITION OF S2, Alexander W. Hull, Andrew Richard Whitehill, Shuhei Ono, Robert W Field 4 MH. Ions Monday, June 20, 2016 – 1:30 PM Room: 274 Medical Sciences Building Chair: Etienne Garand, University of Wisconsin-Madison, Madison, WI, USA MH01 1:30 – 1:45 COMBINED DUNHAM ANALYSIS Of ROTATIONAL AND ELETRONIC TRANSITIONS OF CH+, Shanshan Yu, Brian Drouin, John Pearson, Takayoshi Amano MH02 1:47 – 2:02 + PRECISION SATURATED ABSORPTION SPECTROSCOPY OF H3 , Yu-chan Guan, Yi-Chieh Liao, Yung-Hsiang Chang, Jin-Long Peng, Jow-Tsong Shy MH03 2:04 – 2:19 + HIGHLY ACCURATE AND PRECISE INFRARED TRANSITION FREQUENCIES OF THE H3 CATION, Adam J. Perry, Charles R. Markus, James N. Hodges, G. Stephen Kocheril, Benjamin J. McCall MH04 2:21 – 2:36 + + ROTATIONALLY RESOLVED PHOTOELECTRON SPECTROSCOPIC STUDY OF THE A˜ STATE OF H2O , Clement´ Lauzin, Berenger Gans, Ugo Jacovella, Frederic Merkt MH05 2:38 – 2:48 STUDIES OF 4-CHLORO-2-FLUOROANISOLE BY TWO-COLOR RESONANT TWO-PHOTON MASS-ANALYZED THRESHOLD IONIZATION SPECTROSCOPY, Pei-Ying Wu, Wen-Bih Tzeng MH06 2:50 – 3:00 VIBRONIC AND CATION SPECTROSCOPY OF 3,5-DIFLUOROPHENOL, Wei-Chih Peng, Shen-Yuan Tzeng, Wen-Bih Tzeng Intermission MH07 3:19 – 3:34 IDENTIFICATION OF STRUCTURAL MOTIFS OF IMIDAZOLIUM BASED IONIC LIQUIDS FROM JET-COOLED INFRARED SPECTROSCOPY., Justin W. Young, Ryan S Booth, Christopher Annesley, Jaime A. Stearns MH08 3:36 – 3:51 Ce-PROMOTED BOND ACTIVATION OF PROPENE PROBED BY MASS-ANALYZED THRESHOLD IONIZATION SPECTROSCOPY, Yuchen Zhang, Sudesh Kumari, Dong-Sheng Yang MH09 3:53 – 4:08 SPECTROSCOPIC IDENTIFICATION OF Y(C4H6) ISOMERS FORMED BY YTTRIUM-MEDIATED C-H BOND AC- TIVATION OF BUTENES, Jong Hyun Kim, Dong-Sheng Yang MH10 4:10 – 4:25 INFRARED LASER PHOTODISSOCIATION SPECTROSCOPY OF METAL-ACETYLENE CATIONS IN THE GAS PHASE , Antonio David Brathwaite, Timothy B Ward, Michael A Duncan MH11 4:27 – 4:42 + VELOCITY MAP IMAGING STUDIES OF Mg -L (L = Ar, N2, CO2) COMPLEXES, Jon Maner, Daniel Mauney, Michael A Duncan MH12 4:44 – 4:59 VIBRATIONAL SIGNATURES OF LARGE AMPLITUDE MOTIONS FOR THE SHACKLED HYDRONIUM ION NESTED IN 18-CROWN-6 ETHER USING D2 TAGGING, Chinh H. Duong, Fabian Menges, Stephanie Craig, Conrad T. Wolke, Mark Johnson MH13 5:01 – 5:16 SPECTROSCOPIC OBSERVATION OF WATER-MEDIATED DEFORMATION OF THE CARBOXYLATE-M2+ (M= Mg, Ca) CONTACT ION PAIR, Patrick J Kelleher, Joseph W DePalma, Mark Johnson MH14 5:18 – 5:33 IRMPD ACTION SPECTROSCOPY AND COMPUTATIONAL APPROACHES TO ELUCIDATE GAS-PHASE STRUC- TURES AND ENERGETICS OF 2′-DEOXYCYTIDINE AND CYTIDINE SODIUM COMPLEXES, Yanlong Zhu, Lucas Hamlow, Chenchen He, Juehan Gao, Jos Oomens, M T Rodgers MH15 5:35 – 5:50 INFLUENCE OF 5-HALOGENATION ON THE STRUCTURE OF PROTONATED URIDINE: IRMPD ACTION SPEC- TROSCOPY AND THEORETICAL STUDIES OF THE PROTONATED 5-HALOURIDINES, Harrison Roy, Lucas Ham- low, Justin Lee, M T Rodgers, Giel Berden, Jos Oomens 5 MI. Structure determination Monday, June 20, 2016 – 1:30 PM Room: B102 Chemical and Life Sciences Chair: Stewart E. Novick, Wesleyan University, Middletown, CT, USA MI01 1:30 – 1:45 THE MOLECULAR STRUCTURE OF PHENETOLE STUDIED BY MICROWAVE SPECTROSCOPY AND QUANTUM CHEMICAL CALCULATIONS, Lynn Ferres, Wolfgang Stahl, Ha Vinh Lam Nguyen MI02 1:47 – 2:02 CP-FTMW SPECTROSCOPY OF A CLAISEN REARRANGEMENT PRECURSOR ALLYL PHENYL ETHER, G. S. Grubbs II, Derek S. Frank, Daniel A. Obenchain, S. A. Cooke, Stewart E. Novick MI03 2:04 – 2:19 DETERMINATION OF THE PREFERRED STRUCTURE, DYNAMICS, AND PLANARITY OF SUBSTITUTED ANHY- DRIDES BY CP-FTMW, Timothy J McMahon, Josiah R Bailey, Ryan G Bird, David Pratt MI04 2:21 – 2:36 STRUCTURAL ANALYSIS OF 2-FLUOROPHENOL AND 3-FLUOROPHENOL USING FTMW SPECTROSCOPY , Aimee Bell, Omar Mahassneh, James Singer, Jennifer van Wijngaarden MI05 2:38 – 2:53 STRUCTURAL EXPRESSION OF EXO-ANOMERIC EFFECT, E. R. Alonso, Isabel Pena,˜ Carlos Cabezas, Jose´ L. Alonso MI06 2:55 – 3:10 MICROWAVE SPECTRA, MOLECULAR STRUCTURE AND AROMATIC CHARACTER OF BN-NAPHTHALENE (4A,8A-AZABORANAPHTHALENE) , Aaron M Pejlovas, Stephen G. Kukolich, Arthur J. Ashe III, Adam M Daly MI07 3:12 – 3:27 THE STRUCTURE AND MOLECULAR PARAMETERS OF CAMPHENE DETERMINED BY FOURIER TRANSFORM MICROWAVE SPECTROSCOPY AND QUANTUM CHEMICAL CALCULATIONS, Elias M. Neeman, Pascal Drean,´ T. R. Huet MI08 3:29 – 3:39 N-METHYL INVERSION IN PSEUDO-PELLETIERINE, Montserrat Vallejo-Lopez,´ Patricia Ecija, Emilio J. Cocinero, Alberto Lesarri, Francisco J. Basterretxea, Jose´ A. Fernandez´ Intermission MI09 3:58 – 4:13 13 MICROWAVE SPECTRA FOR THE THREE C1 ISOTOPOLOGUES OF PROPENE AND NEW ROTATIONAL CON- 13 STANTS FOR PROPENE AND ITS C1 ISOTOPOLOGUES , Norman C. Craig, Peter Groner, Andrew R Conrad, Ranil M.