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Items: 1 to 20 of 626

1.

Magnitude and origin of the attraction and directionality of the halogen bonds of the complexes of C6F5X and C6H5X (X = I, Br, Cl and F) with pyridine.

Tsuzuki S, Wakisaka A, Ono T, Sonoda T.

Chemistry. 2012 Jan 16;18(3):951-60. doi: 10.1002/chem.201102562.

PMID:
22189874
2.

Magnitude and Directionality of Halogen Bond of Benzene with C6F5X, C6H5X, and CF3X (X = I, Br, Cl, and F).

Tsuzuki S, Uchimaru T, Wakisaka A, Ono T.

J Phys Chem A. 2016 Sep 8;120(35):7020-9. doi: 10.1021/acs.jpca.6b06295.

PMID:
27525985
3.

Halogen-hydride interaction between Z-X (Z = CN, NC; X = F, Cl, Br) and H-Mg-Y (Y = H, F, Cl, Br, CH3).

Mohajeri A, Alipour M, Mousaee M.

J Phys Chem A. 2011 May 5;115(17):4457-66. doi: 10.1021/jp200689b.

PMID:
21456584
4.

Origin of attraction, magnitude, and directionality of interactions in benzene complexes with pyridinium cations.

Tsuzuki S, Mikami M, Yamada S.

J Am Chem Soc. 2007 Jul 11;129(27):8656-62.

PMID:
17567131
5.

Magnitude and directionality of the interaction energy of the aliphatic CH/pi interaction: significant difference from hydrogen bond.

Tsuzuki S, Honda K, Uchimaru T, Mikami M, Fujii A.

J Phys Chem A. 2006 Aug 24;110(33):10163-8.

PMID:
16913692
6.

Rational modification of the hierarchy of intermolecular interactions in molecular crystal structures by using tunable halogen bonds.

Mínguez Espallargas G, Zordan F, Arroyo Marín L, Adams H, Shankland K, van de Streek J, Brammer L.

Chemistry. 2009 Aug 3;15(31):7554-68. doi: 10.1002/chem.200900410.

PMID:
19593826
7.

Halogen as halogen-bonding donor and hydrogen-bonding acceptor simultaneously in ring-shaped H3N·X(Y)·HF (X = Cl, Br and Y = F, Cl, Br) complexes.

Zhou PP, Qiu WY, Liu S, Jin NZ.

Phys Chem Chem Phys. 2011 Apr 28;13(16):7408-18. doi: 10.1039/c1cp00025j.

PMID:
21423995
9.

Halogen bonded complexes between volatile anaesthetics (chloroform, halothane, enflurane, isoflurane) and formaldehyde: a theoretical study.

Zierkiewicz W, Wieczorek R, Hobza P, Michalska D.

Phys Chem Chem Phys. 2011 Mar 21;13(11):5105-13. doi: 10.1039/c0cp02085k.

PMID:
21290074
10.

Cooperativity between the halogen bond and the hydrogen bond in H3N...XY...HF complexes (X, Y=F, Cl, Br).

Li Q, Lin Q, Li W, Cheng J, Gong B, Sun J.

Chemphyschem. 2008 Oct 24;9(15):2265-9. doi: 10.1002/cphc.200800467.

PMID:
18814160
11.

Characterizing complexes with F-Li...N, H-Li...N, and CH3Li...N lithium bonds: structures, binding energies, and spin-spin coupling constants.

Del Bene JE, Alkorta I, Elguero J.

J Phys Chem A. 2009 Sep 24;113(38):10327-34. doi: 10.1021/jp9035919.

PMID:
19719080
12.

Some measures for making halogen bonds stronger than hydrogen bonds in H2CS-HOX (X = F, Cl, and Br) complexes.

Li QZ, Jing B, Li R, Liu ZB, Li WZ, Luan F, Cheng JB, Gong BA, Sun JZ.

Phys Chem Chem Phys. 2011 Feb 14;13(6):2266-71. doi: 10.1039/c0cp01543a.

PMID:
21125096
13.

CCSD(T) level interaction energy for halogen bond between pyridine and substituted iodobenzenes: origin and additivity of substituent effects.

Tsuzuki S, Uchimaru T, Wakisaka A, Ono T, Sonoda T.

Phys Chem Chem Phys. 2013 Apr 28;15(16):6088-96. doi: 10.1039/c3cp43693d.

PMID:
23503841
14.

Magnitude and nature of carbohydrate-aromatic interactions: ab initio calculations of fucose-benzene complex.

Tsuzuki S, Uchimaru T, Mikami M.

J Phys Chem B. 2009 Apr 23;113(16):5617-21. doi: 10.1021/jp8093726.

PMID:
19331351
15.

FCl:PCX complexes: old and new types of halogen bonds.

Alkorta I, Sanchez-Sanz G, Elguero J, Del Bene JE.

J Phys Chem A. 2012 Mar 8;116(9):2300-8. doi: 10.1021/jp211451y.

PMID:
22376054
16.

Interplay between halogen bonds and hydrogen bonds in OH/SH···HOX···HY (X = Cl, Br; Y = F, Cl, Br) complexes.

Wu W, Zeng Y, Li X, Zhang X, Zheng S, Meng L.

J Mol Model. 2013 Mar;19(3):1069-77. doi: 10.1007/s00894-012-1657-z.

PMID:
23114432
17.

Origin of attraction in chalgogen-nitrogen interaction of 1,2,5-chalcogenadiazole dimers.

Tsuzuki S, Sato N.

J Phys Chem B. 2013 Jun 6;117(22):6849-55. doi: 10.1021/jp403200j.

PMID:
23659630
18.

The cooperativity between hydrogen and halogen bond in the XY···HNC···XY (X, Y = F, Cl, Br) complexes.

Zhao Q, Feng D, Hao J.

J Mol Model. 2011 Nov;17(11):2817-23. doi: 10.1007/s00894-011-0974-y.

PMID:
21287212
19.

Chalcogen- and halogen-bonds involving SX2 (X = F, Cl, and Br) with formaldehyde.

Mo L, Zeng Y, Li X, Zhang X, Meng L.

J Mol Model. 2016 Jul;22(7):167. doi: 10.1007/s00894-016-3037-6.

PMID:
27342252
20.

Reactions between aromatic hydrocarbons and heterocycles: covalent and proton-bound dimer cations of benzene/pyridine.

El-Shall MS, Ibrahim YM, Alsharaeh EH, Meot-Ner Mautner M, Watson SP.

J Am Chem Soc. 2009 Jul 29;131(29):10066-76. doi: 10.1021/ja901130d.

PMID:
19621961
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