참고문헌
- Nitroimidazoles: Chemistry, Pharmacology, and Clinical Application; Breccia, A., Cavalleri, B., Adams, G. E., Eds.; Plenum Press: New York, N.Y., 1982.
- Boyer, J. H. Nitroazoles; The CNitro Derivatives of Five-Membered N- and N,O-Heterocycles; VCH Publishers, Inc.: Deerfield Beach, FL, 1986, Chapter 2.
- Organic Energetic Compounds; Marinkas, P. L., Ed.; Nova Science Publishers, Inc.: Commack, N.Y., 1996.
- Grimmett, M. R. Imidazole and Benzimidazole Synthesis; Academic Press: London, UK, 1997.
- Katritzky, A. R.; Pozharskii, A. F. Handbook of Heterocyclic Chemistry, 2nd ed.; Pergamon: Amsterdam, The Netherlands, 2000.
- Akhavan, J. The Chemistry of Explosives, 2nd ed.; The Royal Society of Chemistry: Cambridge, UK, 2004.
- Coburn, M. D. Ammonium 2,4,5-Trinitroimidazole; U.S. Patent 4,028,154, 1977.
- Grimmett, M. R.; Hua, S.-T.; Chang, K.-C.; Foley, S. A.; Simpson, J. Aust. J. Chem. 1989, 42, 1281. https://doi.org/10.1071/CH9891281
- Damavarapu, R.; Jayasuriya, K.; Vladimroff, T.; Iyer, S. 2,4- Dinitroimidazole - A Less Sensitive Explosive and Propellant Made by Thermal Rearrangement of Molten 1,4-Dinitroimidazole; U.S. Patent 5,387,297, 1995.
- Bracuti, A. J. J. Chem. Crystallogr. 1995, 25, 625. https://doi.org/10.1007/BF01665967
- Agarawal, J. P. Prog. Energy Combust. Sci. 1998, 24, 1. https://doi.org/10.1016/S0360-1285(97)00015-4
- Cho, J. R.; Kim, K. J.; Cho, S. G.; Kim, J. K. J. Heterocyclic Chem. 2002, 39, 141. https://doi.org/10.1002/jhet.5570390121
- Cho, S. G.; Cho, J. R.; Goh, E. M.; Kim, J.-K.; Damavarapu, R.; Surapaneni, R. Propel. Explos. Pyrotech. 2005, 30, 445. https://doi.org/10.1002/prep.200500040
- Talawar, M. B.; Sivabalan, R.; Anniyappan, M.; Gore, G. M.; Asthana, S. N.; Gandhe, S. N. Combust., Expl., Shock Waves 2007, 43, 62. https://doi.org/10.1007/s10573-007-0010-9
- da Silva, G.; Bozzelli, J. W. J. Org. Chem. 2008, 73, 1343. https://doi.org/10.1021/jo701914y
- Su, X.; Cheng, X.; Meng, C.; Yuan, X. J. Hazard. Mater. 2009, 161, 551. https://doi.org/10.1016/j.jhazmat.2008.03.135
- Cho, S. G.; Park, B. S.; Cho, J. R. Propel. Explos. Pyrotech. 1999, 24, 343. https://doi.org/10.1002/(SICI)1521-4087(199912)24:6<343::AID-PREP343>3.0.CO;2-P
- Cho, S. G.; Park, B. S. Int. J. Quantum Chem. 1999, 72, 145. https://doi.org/10.1002/(SICI)1097-461X(1999)72:2<145::AID-QUA7>3.0.CO;2-0
- Gaussian 03, Revision C.02, Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Scuseria, G. E.; Robb, M. A.; Cheeseman, J. R.; Montgomery, J. A., Jr.; Vreven, T.; Kudin, K. N.; Burant, J. C.; Millam, J. M.; Iyengar, S. S.; Tomasi, J.; Barone, V.; Mennucci, B.; Cossi, M.; Scalmani, G.; Rega, N.; Petersson, G. A.; Nakatsuji, H.; Hada, M.; Ehara, M.; Toyota, K.; Fukuda, R.; Hasegawa, J.; Ishida, M.; Nakajima, T.; Honda, Y.; Kitao, O.; Nakai, H.; Klene, M.; Li, X.; Knox, J. E.; Hratchian, H. P.; Cross, J. B.; Adamo, C.; Jaramillo, J.; Gomperts, R.; Stratmann, R. E.; Yazyev, O.; Austin, A. J.; Cammi, R.; Pomelli, C.; Ochterski, J. W.; Ayala, P. Y.; Morokuma, K.; Voth, G. A.; Salvador, P.; Dannenberg, J. J.; Zakrzewski, V. G.; Dapprich, S.; Daniels, A. D.; Strain, M. C.; Farkas, O.; Malick, D. K.; Rabuck, A. D.; Raghavachari, K.; Foresman, J. B.; Ortiz, J. V.; Cui, Q.; Baboul, A. G.; Clifford, S.; Cioslowski, J.; Stefanov, B. B.; Liu, G.; Liashenko, A.; Piskorz, P.; Komaromi, I.; Martin, R. L.; Fox, D. J.; Keith, T.; Al-Laham, M. A.; Peng, C. Y.; Nanayakkara, A.; Challacombe, M.; Gill, P. M. W.; Johnson, B.; Chen, W.; Wong, M. W.; Gonzalez, C.; Pople, J. A. Gaussian, Inc., Wallingford, CT, 2004.
- Hehre, W. J.; Radom, L.; Schleyer, P. v. R.; Pople, J. A. Ab Initio Molecular Orbital Theory; Wiley: New York, 1986.
- Young, D. C. Computational Chemistry: A Practical Guide for Applying Techniques to Real-world Problems; John Wiley & Sons: New York, NY, 2001.
- Koch, W.; Holthausen, M.C. A Chemist's Guide to Density Functional Theory, 2nd ed.; Wiley-VCH: Weinheim, Germany, 2001.
- Habibollahzadeh, D.; Grice, M. E.; Concha, M. C.; Murray, J. S.; Politzer, P. J. Comput. Chem. 1995, 5, 654.
- Cho, S.G., to be published.
- Charlton, M. H.; Docherty, R.; Hutchings, M. G. J. Chem. Soc., Perkin Trans. 2 1993, 2023.
- Ammon, H. L. Struct. Chem. 2001, 12, 205. https://doi.org/10.1023/A:1016607906625
- Murray, J. S.; Brinck, T.; Politzer, P. Chem. Phys. 1996, 204, 289. https://doi.org/10.1016/0301-0104(95)00297-9
- Kim, C. K.; Lee, K. A; Hyun, K. H.; Park, H. J.; Kwack, I. Y.; Kim, C. K.; Lee, H. W.; Lee, B.-S. J. Comput. Chem. 2004, 25, 2073. https://doi.org/10.1002/jcc.20129
- Fried, L. E.; Howard, W. M.; Souers, P. C. Cheetah 2.0 User Manual; Lawrence Livermore National Laboratory Report UCRL MA 117541 Rev. 5, 1998.
- Cho, S. G.; No, K. T.; Goh, E. M.; Kim, J. K.; Shin, J. H.; Joo, Y. D.; Seong, S. Bull. Korean Chem. Soc. 2005, 26, 399. https://doi.org/10.5012/bkcs.2005.26.3.399
- Nefati, H.; Cense, J.-M.; Legendre, J.-J. J. Chem. Inf. Comput. Sci. 1996, 36, 804. https://doi.org/10.1021/ci950223m
- Maana, M. R.; Gee, R. H.; Fried, L. E. J. Phys. Chem. A 2002, 106, 8806. https://doi.org/10.1021/jp0259972
- Holden, J. R.; Du, Z.; Ammon, H. L. Structure and Density Predictions for Energetic Materials. In Energetic Materials. Part 1. Decomposition, Crystal and Molecular Properties; Politzer, P.; Murray, J. S., Eds.; Elsevier: Amsterdam, The Netherlands, 2003; p. 185.
- Gavezzotti, A. Acc. Chem. Res. 1994, 27, 309. https://doi.org/10.1021/ar00046a004
- Dunitz, J. D. Chem. Commun. 2003, 545.
- Kim, C. K.; Cho, S. G.; Lee, K. A.; Kim, C. K.; Park, H.-Y.; Zhang, H.; Lee, H. W.; Lee, B.-S. J. Comput. Chem. 2008, 29, 1818. https://doi.org/10.1002/jcc.20943
- Allen, F. H. Acta Cryst. B58 2002, 380.
피인용 문헌
- and -F Groups vol.33, pp.6, 2012, https://doi.org/10.5012/bkcs.2012.33.6.1913
- Predictive analysis on explosive performance of methylnitroimidzole derivatives vol.28, pp.5, 2015, https://doi.org/10.5806/AST.2015.28.5.347
- Identifying high energy molecules and predicting their detonation potency using chemometric modelling approaches vol.19, pp.4, 2011, https://doi.org/10.1080/13647830.2015.1043747
- Correlation between molecular charge densities and sensitivity of nitrogen-rich heterocyclic nitroazole derivative explosives vol.25, pp.10, 2019, https://doi.org/10.1007/s00894-019-4195-0