Keywords
charge density distribution
hydrogen bonding
intermolecular interactions
L-nitroarginine
X-ray diffraction
Abstract
Detailed analysis of the charge density distribution function in the crystal of L-nitroarginine with two crystallographycally distinct molecules using Richard Bader's ‘Atoms in Molecules’ theory demonstrated the strengthening of hydrogen bonds owing to cooperativity effects and revealed the role of H-bonding in charge transfer in a structurally frustrated system.
References
1.
2.
G. R. Desiraju, Angew. Chem., Int. Ed. Engl., 1995, 34, 2311.
3.
R. Ludwig, Angew. Chem. Int. Ed., 2001, 40, 1808.
4.
P. Vishweshwar, N. J. Babu, A. Nangia, S. A. Mason, H. Puschmann, R. Mondal and J. A. K. Howard, J. Phys. Chem. A, 2004, 108, 9406.
5.
Parra R.D., Ohlssen J.
Journal of Physical Chemistry A,
2008
6.
A. K. Samanta, P. Pandey, B. Bandyopadhyay and T. Chakraborty, J. Phys. Chem. A, 2010, 114, 1650.
7.
Intramolecular H-bonds in the crystal of tetraacetylethane: 3c-4e interaction or a dynamic disorder?
Lyssenko K.A., Lyubetsky D.V., Antipin M.Y.
Mendeleev Communications,
2003
8.
Boese R., Antipin M.Y., Bläser D., Lyssenko K.A.
Journal of Physical Chemistry B,
1998
9.
Lyssenko K.A., Antipin M.Y.
Russian Chemical Bulletin,
2001
10.
Lyssenko K.A., Lyubetsky D.V., Antipin M.Y., Odinets I.L.
Russian Chemical Bulletin,
2005
11.
Lyssenko K.A., Antipin M.Y.
Russian Chemical Bulletin,
2006
12.
Wojciechowski G., Ratajczak-Sitarz M., Katrusiak A., Schilf W., Przybylski P., Brzezinski B.
Journal of Molecular Structure,
2003
13.
14.
Gilli P., Bertolasi V., Ferretti V., Gilli G.
Journal of the American Chemical Society,
1994
15.
Nelyubina Y.V., Antipin M.Y., Lyssenko K.A.
Journal of Physical Chemistry A,
2009
16.
D. G. Golovanov, A. O. Tokareva, A. I. Uraev, Yu. A. Riabuchin, A. I. Pyshev, T. V. Kovaleva, M. Yu. Antipin and K. A. Lyssenko, Izv. Akad. Nauk, Ser. Khim., 2006, 396 (Russ. Chem. Bull., Int. Ed., 2006, 55, 408).
17.
Lyssenko K.A., Borissova A.O., Burlov A.S., Vasilchenko I.S., Garnovskii A.D., Minkin V.I., Antipina M.Y.
Mendeleev Communications,
2007
18.
Nelyubina Y.V., Antipin M.Y., Cherepanov I.A., Lyssenko K.A.
CrystEngComm,
2010
19.
Steed J.W.
CrystEngComm,
2003
20.
Anderson K.M., Goeta A.E., Steed J.W.
Crystal Growth and Design,
2008
21.
Sona V., Gautham N.
Acta Crystallographica Section B Structural Science,
1992
23.
Espinosa E., Molins E., Lecomte C.
Chemical Physics Letters,
1998
24.
Espinosa E., Alkorta I., Rozas I., Elguero J., Molins E.
Chemical Physics Letters,
2001
25.
K. A. Lyssenko, Yu. V. Nelyubina, R. G. Kostyanovsky and M. Yu. Antipin, ChemPhysChem, 2006, 7, 2453.
26.
K. A. Lyssenko, A. A. Korlyukov, D. G. Golovanov, S. Yu. Ketkov and M. Yu. Antipin, J. Phys. Chem. A, 2006, 110, 6545.
27.
Lyssenko K.A., Korlyukov A.A., Antipin M.Y.
Mendeleev Communications,
2005
28.
Glukhov I.V., Lyssenko K.A., Korlyukov A.A., Antipin M.Y.
Faraday Discussions,
2007
29.
L. Sobczyk, S. J. Grabowski and T. M. Krygowski, Chem. Rev., 2005, 105, 3513.
30.
Puntus L.N., Lyssenko K.A., Antipin M.Y., Bünzli J.G.
Inorganic Chemistry,
2008
31.
Borissova A.O., Korlyukov A.A., Antipin M.Y., Lyssenko K.A.
Journal of Physical Chemistry A,
2008
32.
Borissova A.O., Antipin M.Y., Lyssenko K.A.
Journal of Physical Chemistry A,
2009
33.
Borissova A.O., Antipin M.Y., Perekalin D.S., Lyssenko K.A.
CrystEngComm,
2008
34.
Yu. V. Nelyubina, I. V. Glukhov, M. Yu. Antipin and K. A. Lyssenko, Chem. Commun., 2010, 46, 3469.
35.
R. Flaig, T. Koritsanszky, B. Dittrich, A. Wagner and P. Luger, J. Am. Chem. Soc., 2002, 124, 3407.
36.
Lyssenko K.A., Barzilovich P.Y., Nelyubina Y.V., Astaf’ev E.A., Antipin M.Y., Aldoshin S.M.
Russian Chemical Bulletin,
2009
37.
Murmann R.K., Glaser R., Barnes C.L.
Journal of Chemical Crystallography,
2005
38.
P. Jeschke, H. Uneme, J. Benet-Buchholz, J. Stolting, W. Sirges, M. E. Beck and W. Etzel, Pflanzenschutz-Nachr. Bayer (Engl. Ed.), 2003, 56, 5.
39.
Mascal M., Infantes L., Chisholm J.
Angewandte Chemie - International Edition,
2006
40.
10.1016/j.mencom.2010.09.006_bib0100_2
Boyd
JCTC,
2007
41.
Castellano R.
Current Organic Chemistry,
2004