The production of HCN dimer and more complex oligomers in dense interstellar clouds
Open accessAbstract
Using quantum chemical and kinetic techniques, we show that the reaction between two HCN molecules under interstellar conditions cannot lead efficiently to a dimer of this species (H2C2N2), whatever its structure. If the dimerization reaction does not occur efficiently, then it is impossible to synthesize detectable abundances of the pre-biotic HCN oligomer adenine (H5C5N5) in the interstellar medium via successive neutral-neutral reactions between HCN and its dimer, trimer, and tetramer.
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Interstellar gas-phase production routes are incapable of producing significant amounts of HCN, in spite of its detection.
“However, it has been found that interstellar gas-phase production routes are incapable of producing significant amounts of HCN [128,129], in spite of its detection.”
From The future of quantum biology (2018) · cites this paper as [128]
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Density-functional thermochemistry. III. The role of exact exchange
Becke, A. D. (1993) · The Journal of Chemical Physics · doi:10.1063/1.464913 · Cited by 103,767 · see citing works
A Rapidly Convergent Descent Method for Minimization
Fletcher, R., & Powell, M. J. D. (1963) · The Computer Journal · doi:10.1093/comjnl/6.2.163 · Cited by 4,626 · see citing works
Mechanism of Synthesis of Adenine from Hydrogen Cyanide under Possible Primitive Earth Conditions
ORÓ, J. (1961) · Nature · doi:10.1038/1911193a0 · Cited by 396 · see citing works
Lee, H.-H., Bettens, R. P. A., & Herbst, E. (1996) · Astronomy & Astrophysics Supplement Series · doi:10.1051/aas:1996232 · Cited by 246 · see citing works
Self-citationThe vibrational ground state rotational spectroscopic constants and structure of the HCN dimer
Buxton, L. W., Campbell, E. J., & Flygare, W. H. (1981) · Chemical Physics · doi:10.1016/0301-0104(81)80161-9 · Cited by 130 · see citing works
Giauque, W. F., & Ruehrwein, R. A. (1939) · Journal of the American Chemical Society · doi:10.1021/ja01265a017 · Cited by 93 · see citing works
Frisch, M. J., Trucks, G. W., & Cheeseman, J. R. (1996) · Theoretical and computational chemistry · doi:10.1016/s1380-7323(96)80100-2 · Cited by 57 · see citing works
Integrated intensities for some infrared absorption bands of HCN
Smith, I. W. M. (1981) · Journal of the Chemical Society Faraday Transactions 2 Molecular and Chemical Physics · doi:10.1039/f29817702357 · Cited by 52 · see citing works
Self-citationBates, D. R., & Herbst, E. (1988) · Astrophysics and space science library · doi:10.1007/978-94-009-3007-0_2 · Cited by 43 · see citing works
Self-citationPossible precursors in HCN oligomerization
Clemmons, J. H., Jasien, P. G., & Dykstra, C. E. (1983) · Molecular Physics · doi:10.1080/00268978300100461 · Cited by 30 · see citing works
A search for the interstellar HCN dimer
Schenewerk, M. S., Jewell, P. R., Snyder, L. E., Buxton, L. W., Campbell, E. J., & Flygare, W. H. (1985) · The Astrophysical Journal · doi:10.1086/163439 · Cited by 5 · see citing works
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Research works printed but not linked: 2
- Frisch, M. J., Trucks, G. W., & Cheeseman, J. R. 1996, in Recent Developments and Applications of Modern Density Functional Theory, Theoretical and Computational Chemistry, vol. 4, ed. J. Seminario (Amsterdam: Elsevier), 679
- Smith, I. W. M. 1981, J. Chem. Soc. Faraday Trans. 2, 77, 2357
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Marais, A., Adams, B., Ringsmuth, A. K., Ferretti, M., Gruber, J. M., Hendrikx, R., Schuld, M., Smith, S. L., Sinayskiy, I., Krüger, T. P. J., et al. (2018) · Journal of The Royal Society Interface · doi:10.1098/rsif.2018.0640 · Cited by 274 · see citing works
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Saladino, R., Botta, G., Pino, S., Costanzo, G., & Di Mauro, E. (2012) · Chemical Society Reviews · doi:10.1039/c2cs35066a · Cited by 215 · see citing works
Photoion mass spectrometry of adenine, thymine and uracil in the 6–22eV photon energy range
Jochims, H. ‐., Schwell, M., Baumgärtel, H. G., & Leach, S. (2005) · Chemical Physics · doi:10.1016/j.chemphys.2005.03.008 · Cited by 192 · see citing works
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Zaleski, D. P., Seifert, N. A., Steber, A. L., Muckle, M. T., Loomis, R. A., Corby, J. F., Martinez, O., Crabtree, K. N., Jewell, P. R., Hollis, J. M., et al. (2013) · The Astrophysical Journal · doi:10.1088/2041-8205/765/1/l10 · Cited by 133 · see citing works
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Rivilla, V. M., Martín-Pintado, J., Jiménez-Serra, I., Zeng, S., Martín, S., Armijos-Abendaño, J., Requena-Torres, M. A., Aladro, R., & Riquelme, D. (2018) · Monthly Notices of the Royal Astronomical Society Letters · doi:10.1093/mnrasl/sly228 · Cited by 101 · see citing works
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Peeters, Z., Botta, O., Charnley, S. B., Kisiel, Z., Kuan, Y. ‐., & Ehrenfreund, P. (2005) · Astronomy and Astrophysics · doi:10.1051/0004-6361:20042443 · Cited by 99 · see citing works
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Peeters, Z., Botta, O., Charnley, S. B., Ruiterkamp, R., & Ehrenfreund, P. (2003) · The Astrophysical Journal · doi:10.1086/378346 · Cited by 93 · see citing works
Glaser, R., Hodgen, B., Farrelly, D., & McKee, E. (2007) · Astrobiology · doi:10.1089/ast.2006.0112 · Cited by 83 · see citing works
Vazart, F., Latouche, C., Skouteris, D., Balucani, N., & Barone, V. (2015) · The Astrophysical Journal · doi:10.1088/0004-637x/810/2/111 · Cited by 74 · see citing works
Schwell, M., Jochims, H. ‐., Baumgärtel, H. G., & Leach, S. (2008) · Chemical Physics · doi:10.1016/j.chemphys.2008.08.009 · Cited by 60 · see citing works
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Puzzarini, C., & Barone, V. (2020) · Physical Chemistry Chemical Physics · doi:10.1039/d0cp00561d · Cited by 54 · see citing works
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Fragmentation of adenine under energy control
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Mechanisms of Prebiotic Adenine Synthesis from HCN by Oligomerization in the Gas Phase
Jung, S. H., & Choe, J. C. (2013) · Astrobiology · doi:10.1089/ast.2013.0973 · Cited by 41 · see citing works
Kroonblawd, M., Lindsey, R., & Goldman, N. (2019) · Chemical Science · doi:10.1039/c9sc00155g · Cited by 23 · see citing works
Prebiotic Chemistry of HCN Tetramerization by Automated Reaction Search.
Nandi, S., Bhattacharyya, D., & Anoop, A. (2018) · Chemistry · doi:10.1002/chem.201705492 · Cited by 31 · see citing works
Quantum chemical study of a new reaction pathway for the adenine formation in the interstellar space
Gupta, V. P., Tandon, P., Rawat, P., Singh, R. N., & Singh, A. P. (2011) · Astronomy and Astrophysics · doi:10.1051/0004-6361/201015557 · Cited by 37 · see citing works
Fragmentation patterns of core-ionized thymine and 5-bromouracil
Itälä, E., Ha, D. T., Kooser, K., Rachlew, E., Huels, M. A., & Kukk, E. (2010) · The Journal of Chemical Physics · doi:10.1063/1.3505140 · Cited by 36 · see citing works
Dimerization of HCN in the gas phase: A theoretical mechanistic study
Yim, M. K., & Choe, J. C. (2012) · Chemical Physics Letters · doi:10.1016/j.cplett.2012.04.042 · Cited by 35 · see citing works
Bagag, A., Giuliani, A., & Laprévôte, O. (2007) · International Journal of Mass Spectrometry · doi:10.1016/j.ijms.2007.03.010 · Cited by 34 · see citing works
A Dimer of Hydrogen Cyanide Stabilized by a Lewis Acid
Bläsing, K., Bresien, J., Labbow, R., Schulz, A., & Villinger, A. (2018) · Angewandte Chemie International Edition · doi:10.1002/anie.201804193 · Cited by 32 · see citing works
Cataldo, F., Lilla, E., Ursini, O., & Angelini, G. (2009) · Journal of Analytical and Applied Pyrolysis · doi:10.1016/j.jaap.2009.10.002 · Cited by 32 · see citing works
Martin, S., Brédy, R., Allouche, A.-R., Bernard, J., Salmoun, A., Li, B., & Chen, L. (2008) · Physical Review A · doi:10.1103/physreva.77.062513 · Cited by 31 · see citing works
Sandström, H., & Rahm, M. (2021) · ACS Earth and Space Chemistry · doi:10.1021/acsearthspacechem.1c00195 · Cited by 29 · see citing works
Density functional theory study of (HCN) clusters up to n= 10
Adrian-Scotto, M., & Vasilescu, D. (2006) · Journal of Molecular Structure THEOCHEM · doi:10.1016/j.theochem.2006.09.020 · Cited by 29 · see citing works
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Evans, N. L., Bennett, C. J., Ullrich, S., & Kaiser, R. I. (2011) · The Astrophysical Journal · doi:10.1088/0004-637x/730/2/69 · Cited by 25 · see citing works
Majumdar, L., Das, A., Chakrabarti, S. K., & Chakrabarti, S. (2012) · Research in Astronomy and Astrophysics · doi:10.1088/1674-4527/12/12/003 · Cited by 24 · see citing works
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Szöri, M., & Jedlovszky, P. (2014) · The Journal of Physical Chemistry C · doi:10.1021/jp4110954 · Cited by 24 · see citing works
Thripati, S., & Ramabhadran, R. O. (2017) · The Journal of Physical Chemistry A · doi:10.1021/acs.jpca.7b08002 · Cited by 23 · see citing works
Chemical models of interstellar cyanomethanimine isomers
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Self-citationCan Cytosine, Uracil, and Thymine Be Formed from HC 3 N and H 2 NCO + in Interstellar Space?
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Ribeiro, F. D. A., Almeida, G. C., Garcia‐Basabe, Y., Wolff, W., Boechat-Roberty, H. M., & Rocco, M. L. M. (2015) · Physical Chemistry Chemical Physics · doi:10.1039/c5cp05040e · Cited by 23 · see citing works
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Merz, K. M., Aguiar, E. C., & da Silva, J. B. P. (2014) · The Journal of Physical Chemistry A · doi:10.1021/jp5018778 · Cited by 21 · see citing works
Ma, J., Dasgupta, P. Κ., Blackledge, W., & Boss, G. R. (2010) · Environmental Science & Technology · doi:10.1021/es1001192 · Cited by 20 · see citing works
On the physical origins of interaction-induced vibrational (hyper)polarizabilities
Zaleśny, R., Garcia‐Borràs, M., Góra, R. W., Medveď, M., & Luis, J. M. (2016) · Physical Chemistry Chemical Physics · doi:10.1039/c6cp02500e · Cited by 19 · see citing works
Chemical models of adenine precursors cyanamide and carbodiimide in the interstellar medium
Zhang, X., Quan, D., Li, R., Esimbek, J., Chen, L.-F., Zhao, G., & Zhou, Y. (2023) · Monthly Notices of the Royal Astronomical Society · doi:10.1093/mnras/stad627 · Cited by 16 · see citing works
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Szentirmai, V., Szőri, M., Picaud, S., & Jedlovszky, P. (2014) · The Journal of Physical Chemistry C · doi:10.1021/acs.jpcc.6b05863 · Cited by 12 · see citing works
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Benallou, A. (2018) · Journal of Taibah University for Science · doi:10.1080/16583655.2018.1543163 · Cited by 12 · see citing works
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de Oliveira, P. M. C., da Silva, J. A. B., & Longo, R. L. (2017) · Journal of Molecular Modeling · doi:10.1007/s00894-017-3235-x · Cited by 8 · see citing works
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Perrero, J., Vitorino, J., Congiu, E., Ugliengo, P., Rimola, A., & Dulieu, F. (2024) · Physical Chemistry Chemical Physics · doi:10.1039/d4cp01934b · Cited by 7 · see citing works
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Lu, Y., & Quan, D. (2025) · Chinese Science Bulletin (Chinese Version) · doi:10.1360/tb-2025-0047 · Cited by 1 · see citing works
Bancone, N., Pantaleone, S., Pareras, G., Ugliengo, P., Rimola, A., & Corno, M. (2025) · ACS Earth and Space Chemistry · doi:10.1021/acsearthspacechem.5c00166 · Cited by 1 · see citing works
Computational Modeling of DNA and RNA Fragments
Šponer, J., Shukla, M. K., Wang, J., & Leszczyński, J. (2017) · Springer eBooks · doi:10.1007/978-3-319-27282-5_35 · Cited by 1 · see citing works
Computational Modeling of DNA and RNA Fragments
Šponer, J., Shukla, M. K., & Leszczyński, J. (2012) · Springer eBooks · doi:10.1007/978-94-007-0711-5_35
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Thomas, B., Geetha, D., Shanmugasundaram, S., Jothi, B. S., Kanisha, S., & Gupta, D. (2026) · Radiation Physics and Chemistry · doi:10.1016/j.radphyschem.2026.113918
Dyakov, Y. A., Rodionov, A. I., Rodionov, I. D., Rodionova, I. P., Stepanov, I. G., Shestakov, D. V., & Голубков, М. Г. (2026) · Russian Journal of Physical Chemistry B · doi:10.1134/s1990793126700739
- Authors
- Smith, I. W. M., Talbi, D., & Herbst, E.
- Affiliations
- University of Birmingham (GB)
- Université Nice Sophia Antipolis (FR)
- The Ohio State University (US)
- Venue
- Astronomy & Astrophysics
- Publisher
- EDP Sciences
- Published
- 2001-04
- Volume
- 369
- Issue
- 2
- Pages
- 611-615
- ISSN
- 0004-6361 (ISSN-L)
- 1432-0746
- OpenAlex
- W2056587395
- Cited by
- 66
- References
- 11
- Citations by year
- 2026: 2 · 2025: 3 · 2024: 4 · 2023: 2 · 2022: 1 · 2021: 3 · 2020: 2 · 2019: 2 · 2018: 6 · 2017: 4 · 2016: 6 · 2015: 5 · 2014: 3 · 2013: 2 · 2012: 4
- FWCI
- 0.20
- Type
- journal article
- Language
- en
- Open access
- bronze
- doi.org
- Locations
- Astronomy and Astrophysics (publishedVersion)
- Springer Link (Chiba Institute of Technology) (submittedVersion)
- University of Birmingham Research Portal (University of Birmingham) (submittedVersion)
- Funders
- National Science Foundation
- Ohio State University
- Topics
- Physical Sciences › Physics and Astronomy › Astronomy and Astrophysics › Astrophysics and Star Formation Studies
- Physical Sciences › Physics and Astronomy › Astronomy and Astrophysics › Origins and Evolution of Life
- Physical Sciences › Physics and Astronomy › Astronomy and Astrophysics › Astro and Planetary Science
- Keywords
- interstellar medium, dense interstellar clouds, prebiotic chemistry, adenine synthesis, neutral-neutral reactions, reaction kinetics, astrochemistry
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