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A Theoretical Investigation of OH• + H2CCNH Reactivity: Interstellar Insights into Glycolonitrile Formation
Terri E. Field-Theodore, Mattia Ravasio, Silvia Alessandrini, Carlo Cavallotti and Cristina Puzzarini The Astrophysical Journal 993(2) 179 (2025) https://doi.org/10.3847/1538-4357/ae058d
The rotation-tunneling spectrum of 3-hydroxypropenal and confirmation of its detection toward IRAS 16293-2422 B
H. S. P. Müller, A. Coutens, J. K. Jørgensen, L. Margulès, R. A. Motiyenko and J.-C. Guillemin Astronomy & Astrophysics 687 A8 (2024) https://doi.org/10.1051/0004-6361/202450029
A deep search for large complex organic species toward IRAS16293-2422 B at 3 mm with ALMA
P. Nazari, J. S. Y. Cheung, J. Ferrer Asensio, N. M. Murillo, E. F. van Dishoeck, J. K. Jørgensen, T. L. Bourke, K.-J. Chuang, M. N. Drozdovskaya, G. Fedoseev, R. T. Garrod, S. Ioppolo, H. Linnartz, B. A. McGuire, H. S. P. Müller, D. Qasim and S. F. Wampfler Astronomy & Astrophysics 686 A59 (2024) https://doi.org/10.1051/0004-6361/202347832
Kinetics and Thermochemistry of Hydroxyacetonitrile (HOCH2CN) and Its Reaction with Hydroxyl Radical
Propyl-cyanide isomer formation on interstellar ices from radical association: a quantum theoretical study
Boutheïna Kerkeni, Victoria Gámez, Ghofrane Ouerfelli, Maria Luisa Senent and Nicole Feautrier Monthly Notices of the Royal Astronomical Society 522(4) 5254 (2023) https://doi.org/10.1093/mnras/stad1197
Rotation-tunnelling spectrum and astrochemical modelling of dimethylamine, CH3NHCH3, and searches for it in space
H S P Müller, R T Garrod, A Belloche, V M Rivilla, K M Menten, I Jiménez-Serra, J Martín-Pintado, F Lewen and S Schlemmer Monthly Notices of the Royal Astronomical Society 523(2) 2887 (2023) https://doi.org/10.1093/mnras/stad1549
Rotational spectroscopy and astronomical search for the 2-hydroxyacetonitrile isotopologues HO13CH2CN, HOCH213CN, and DOCH2CN
L Margulès, A Coutens, N F W Ligterink, A Ahmadi, R A Motiyenko, E A Alekseev, C Vastel, E Caux and J-C Guillemin Monthly Notices of the Royal Astronomical Society 524(1) 1211 (2023) https://doi.org/10.1093/mnras/stad1834
Molecular Precursors of the RNA-World in Space: New Nitriles in the G+0.693−0.027 Molecular Cloud
(Sub-)millimeter-wave spectroscopy of gauche-propanal
Oliver Zingsheim, Holger S.P. Müller, Luis Bonah, Frank Lewen, Sven Thorwirth and Stephan Schlemmer Journal of Molecular Spectroscopy 384 111565 (2022) https://doi.org/10.1016/j.jms.2021.111565
Laboratory rotational spectroscopy of acrylamide and a search for acrylamide and propionamide toward Sgr B2(N) with ALMA
Proton inversion tunneling in the rotational spectrum of acetone cyanohydrin
Philipp Buschmann, Kevin G. Lengsfeld, Kathryn Aydt, Michaela K. Jahn, Sven Herbers, Michael J. Travers, Ha Vinh Lam Nguyen and Jens-Uwe Grabow Journal of Molecular Spectroscopy 373 111372 (2020) https://doi.org/10.1016/j.jms.2020.111372
Large amplitude vibrations of acetyl isocyanate, methyl cyanoformate, and acetyl cyanate
Understanding propyl cyanide and its isomers formation: ab initio study of the spectroscopy and reaction mechanisms
Boutheïna Kerkeni, Victoria Gámez, Maria Luisa Senent and Nicole Feautrier Physical Chemistry Chemical Physics 21(42) 23375 (2019) https://doi.org/10.1039/C9CP04365A
First detection of the pre-biotic molecule glycolonitrile (HOCH2CN) in the interstellar medium
S Zeng, D Quénard, I Jiménez-Serra, J Martín-Pintado, V M Rivilla, L Testi and R Martín-Doménech Monthly Notices of the Royal Astronomical Society: Letters 484(1) L43 (2019) https://doi.org/10.1093/mnrasl/slz002
Important features of the potential energy surface of the methylamine plus O(1D) reaction
Mark E. Wolf, Preston R. Hoobler, Justin M. Turney and Henry F. Schaefer Physical Chemistry Chemical Physics 21(43) 24194 (2019) https://doi.org/10.1039/C9CP05039F
Reactions of Glycolonitrile with Ammonia and Water: A Free Energy Map
Internal Rotation of OH Group in 4-Hydroxy-2-butynenitrile Studied by Millimeter-Wave Spectroscopy
Roman A. Motiyenko, Laurent Margulès, Maria L. Senent and Jean-Claude Guillemin The Journal of Physical Chemistry A 122(12) 3163 (2018) https://doi.org/10.1021/acs.jpca.7b12051
Laboratory spectroscopy of methoxymethanol in the millimeter-wave range
Roman A. Motiyenko, Laurent Margulès, Didier Despois and Jean-Claude Guillemin Physical Chemistry Chemical Physics 20(8) 5509 (2018) https://doi.org/10.1039/C7CP05932A
Structural and spectroscopic characterization of various isotopologues of 2-hydroxyacetonitrile using highly correlated ab initio methods