-
1
-
-
0034317323
-
Blue-shifting hydrogen bonds
-
Hobza, P.; Havlas, Z. Blue-shifting hydrogen bonds Chem. Rev. 2000, 100, 4253-4264
-
(2000)
Chem. Rev.
, vol.100
, pp. 4253-4264
-
-
Hobza, P.1
Havlas, Z.2
-
2
-
-
0000216832
-
The C-H⋯O hydrogen bond: Structural implications and supramolecular design
-
Desiraju, G. R. The C-H⋯O hydrogen bond: Structural implications and supramolecular design Acc. Chem. Res. 1996, 29, 441-449
-
(1996)
Acc. Chem. Res.
, vol.29
, pp. 441-449
-
-
Desiraju, G.R.1
-
3
-
-
0037046781
-
Blue-shifting hydrogen bonds
-
Hermansson, K. Blue-shifting hydrogen bonds J. Phys. Chem. A 2002, 106, 4695-4702
-
(2002)
J. Phys. Chem. A
, vol.106
, pp. 4695-4702
-
-
Hermansson, K.1
-
4
-
-
0037077673
-
On the physical origin of blue-shifted hydrogen bonds
-
Li, X.; Liu, L.; Schlegel, B. On the physical origin of blue-shifted hydrogen bonds J. Am. Chem. Soc. 2002, 124, 9639-9647
-
(2002)
J. Am. Chem. Soc.
, vol.124
, pp. 9639-9647
-
-
Li, X.1
Liu, L.2
Schlegel, B.3
-
5
-
-
3242888424
-
Blue-shifting or red-shifting hydrogen bonding? Predictions for haloform complexes with dimethyl ether on the basis of perturbation theory
-
Herrebout, W. A.; Delanoye, S. N.; van der Veken, B. J. Blue-shifting or red-shifting hydrogen bonding? Predictions for haloform complexes with dimethyl ether on the basis of perturbation theory J. Phys. Chem. A 2004, 108, 6059-6064
-
(2004)
J. Phys. Chem. A
, vol.108
, pp. 6059-6064
-
-
Herrebout, W.A.1
Delanoye, S.N.2
Van Der Veken, B.J.3
-
6
-
-
33645096144
-
Theoretical investigations into the blue-shifting hydrogen bond in benzene complexes
-
Spirko, V.; Hobza, P. Theoretical investigations into the blue-shifting hydrogen bond in benzene complexes ChemPhysChem. 2006, 7, 640-643
-
(2006)
ChemPhysChem.
, vol.7
, pp. 640-643
-
-
Spirko, V.1
Hobza, P.2
-
7
-
-
0037130517
-
Vibrational spectroscopy of hydrogen bonding: Origin of the different behavior of the C-H⋯O hydrogen bond
-
Qian, W.; Krimm, S. Vibrational spectroscopy of hydrogen bonding: Origin of the different behavior of the C-H⋯O hydrogen bond J. Phys. Chem. A 2002, 106, 6628-6636
-
(2002)
J. Phys. Chem. A
, vol.106
, pp. 6628-6636
-
-
Qian, W.1
Krimm, S.2
-
8
-
-
33845740335
-
Observation of weak C-H⋯O hydrogen bonding to unactivated alkanes
-
Wang, X.-B.; Woo, H.-K.; Kiran, B.; Wang, L.-S. Observation of weak C-H⋯O hydrogen bonding to unactivated alkanes Angew. Chem. 2005, 117, 5048-5052
-
(2005)
Angew. Chem.
, vol.117
, pp. 5048-5052
-
-
Wang, X.-B.1
Woo, H.-K.2
Kiran, B.3
Wang, L.-S.4
-
9
-
-
47249107330
-
Blue shifts vs red shifts in σ-hole bonding
-
Murray, J. S.; Concha, M. C.; Lane, P.; Hobza, P.; Politzer, P. Blue shifts vs red shifts in σ-hole bonding J. Mol. Model. 2008, 14, 699-704
-
(2008)
J. Mol. Model.
, vol.14
, pp. 699-704
-
-
Murray, J.S.1
Concha, M.C.2
Lane, P.3
Hobza, P.4
Politzer, P.5
-
10
-
-
0034927557
-
The H-index unambiguously discriminates between hydrogen bonding and improper blue-shifting hydrogen bonding
-
Hobza, P. The H-index unambiguously discriminates between hydrogen bonding and improper blue-shifting hydrogen bonding Phys. Chem. Chem. Phys. 2001, 3, 2555-2556
-
(2001)
Phys. Chem. Chem. Phys.
, vol.3
, pp. 2555-2556
-
-
Hobza, P.1
-
11
-
-
0035859404
-
Improper, blue-shifting hydrogen bond between fluorobenzene and fluoroform
-
Reimann, B.; Buchhold, K.; Vaupel, S.; Brutschy, B.; Havlas, Z.; Spirko, V.; Hobza, P. Improper, blue-shifting hydrogen bond between fluorobenzene and fluoroform J. Phys. Chem. A 2001, 105, 5560-5566
-
(2001)
J. Phys. Chem. A
, vol.105
, pp. 5560-5566
-
-
Reimann, B.1
Buchhold, K.2
Vaupel, S.3
Brutschy, B.4
Havlas, Z.5
Spirko, V.6
Hobza, P.7
-
12
-
-
16244416878
-
Intermolecular orbital repulsion effect on the blue-shifted hydrogen bond
-
Wang, S.-C.; Sahu, P. K.; Lee, S.-L. Intermolecular orbital repulsion effect on the blue-shifted hydrogen bond Chem. Phys. Lett. 2005, 406, 143-147
-
(2005)
Chem. Phys. Lett.
, vol.406
, pp. 143-147
-
-
Wang, S.-C.1
Sahu, P.K.2
Lee, S.-L.3
-
13
-
-
34247533707
-
Red-, blue-, or no-shift in hydrogen bonds: A unified explanation
-
Joseph, J.; Jemmis, E. D. Red-, blue-, or no-shift in hydrogen bonds: A unified explanation J. Am. Chem. Soc. 2007, 129, 4620-4632
-
(2007)
J. Am. Chem. Soc.
, vol.129
, pp. 4620-4632
-
-
Joseph, J.1
Jemmis, E.D.2
-
14
-
-
80855150844
-
Red-and blue-shifted hydrogen bonds: The bent rule from quantum theory of atoms in molecules perspective
-
Grabowski, S. J. Red-and blue-shifted hydrogen bonds: The bent rule from quantum theory of atoms in molecules perspective J. Phys. Chem. A 2011, 115, 12789-12799
-
(2011)
J. Phys. Chem. A
, vol.115
, pp. 12789-12799
-
-
Grabowski, S.J.1
-
15
-
-
57149129443
-
Spectroscopic and structural signature of the CH-O hydrogen bond
-
Scheiner, S.; Kar, T. Spectroscopic and structural signature of the CH-O hydrogen bond J. Phys. Chem. A 2008, 112, 11854-11860
-
(2008)
J. Phys. Chem. A
, vol.112
, pp. 11854-11860
-
-
Scheiner, S.1
Kar, T.2
-
16
-
-
77954216047
-
Blue shifted intramolecular C-H⋯O improper hydrogen bonds in conformers of zidovudine
-
Chen, F.; Selvam, L.; Wang, F. Blue shifted intramolecular C-H⋯O improper hydrogen bonds in conformers of zidovudine Chem. Phys. Lett. 2010, 493, 358-363
-
(2010)
Chem. Phys. Lett.
, vol.493
, pp. 358-363
-
-
Chen, F.1
Selvam, L.2
Wang, F.3
-
17
-
-
63849282622
-
Blue shifting C-H⋯O hydrogen bonded complexes between chloroform and small cyclic ketones: Ring-size effects on stability and spectral shifts
-
Mukhopadhyay, A.; Mukherjee, M.; Pandey, P.; Samanta, A. K.; Bandyopadhyay, B.; Chakraborty, T. Blue shifting C-H⋯O hydrogen bonded complexes between chloroform and small cyclic ketones: Ring-size effects on stability and spectral shifts J. Phys. Chem. A 2009, 113, 3078-3087
-
(2009)
J. Phys. Chem. A
, vol.113
, pp. 3078-3087
-
-
Mukhopadhyay, A.1
Mukherjee, M.2
Pandey, P.3
Samanta, A.K.4
Bandyopadhyay, B.5
Chakraborty, T.6
-
18
-
-
17044399743
-
A cryosolution infrared study of the complexes of fluoroform with ammonia and pyridine: Evidence for a C-H⋯N pseudo blue-shifting hydrogen bond
-
Herrebout, W. A.; Melikova, S. M.; Delanoye, S. N.; Rutkowski, K. S.; Shchepkin, D. N.; van der Veken, B. J. A cryosolution infrared study of the complexes of fluoroform with ammonia and pyridine: Evidence for a C-H⋯N pseudo blue-shifting hydrogen bond J. Phys. Chem. A 2005, 109, 3038-3044
-
(2005)
J. Phys. Chem. A
, vol.109
, pp. 3038-3044
-
-
Herrebout, W.A.1
Melikova, S.M.2
Delanoye, S.N.3
Rutkowski, K.S.4
Shchepkin, D.N.5
Van Der Veken, B.J.6
-
19
-
-
36949064021
-
The C-H⋯O hydrogen bond in crystals
-
Sutor, D. J. The C-H⋯O hydrogen bond in crystals Nature 1962, 4836, 68-69
-
(1962)
Nature
, vol.4836
, pp. 68-69
-
-
Sutor, D.J.1
-
20
-
-
80053556667
-
The role of weak hydrogen bonds in chiral recognition
-
Scuderi, D.; Barbu-Debus, K. L.; Zehnacker, A. The role of weak hydrogen bonds in chiral recognition Phy. Chem. Chem. Phys. 2011, 13, 17916-17929
-
(2011)
Phy. Chem. Chem. Phys.
, vol.13
, pp. 17916-17929
-
-
Scuderi, D.1
Barbu-Debus, K.L.2
Zehnacker, A.3
-
21
-
-
84876499989
-
Oxyanion hole stabilization by C-H⋯O interaction in transition state -A three-point interaction model for Cinchona alkaloid-catalyzed asymmetric methanolysis of Meso-cyclic anhydrides
-
Yang, H.; Wong, M. W. Oxyanion hole stabilization by C-H⋯O interaction in transition state-A three-point interaction model for Cinchona alkaloid-catalyzed asymmetric methanolysis of Meso-cyclic anhydrides J. Am. Chem. Soc. 2013, 135, 5808-5818
-
(2013)
J. Am. Chem. Soc.
, vol.135
, pp. 5808-5818
-
-
Yang, H.1
Wong, M.W.2
-
23
-
-
0242498475
-
Experimental evidence for intramolecular blue-shifting C-H⋯O hydrogen bonding by matrix-isolation infrared spectroscopy
-
Matsuura, H.; Yoshida, H.; Hieda, M.; Yamannaka, S.; Harada, T.; Shin-ya, K.; Ohno, K. Experimental evidence for intramolecular blue-shifting C-H⋯O hydrogen bonding by matrix-isolation infrared spectroscopy J. Am. Chem. Soc. 2003, 125, 13910-13911
-
(2003)
J. Am. Chem. Soc.
, vol.125
, pp. 13910-13911
-
-
Matsuura, H.1
Yoshida, H.2
Hieda, M.3
Yamannaka, S.4
Harada, T.5
Shin-Ya, K.6
Ohno, K.7
-
24
-
-
33746339544
-
Origin of the blue shift of the CH stretching band for 2-butoxyethanol in water
-
Katsumoto, Y.; Komatsu, H.; Ohno, K. Origin of the blue shift of the CH stretching band for 2-butoxyethanol in water J. Am. Chem. Soc. 2006, 128, 9278-9279
-
(2006)
J. Am. Chem. Soc.
, vol.128
, pp. 9278-9279
-
-
Katsumoto, Y.1
Komatsu, H.2
Ohno, K.3
-
25
-
-
63849298906
-
Remarkable blue shifts of C-H and N-H stretching frequencies in the interaction of monosubstituted formaldehyde and thioformaldehyde with nitrosyl hydride
-
Trung, N. T.; Hue, T. T.; Nguyen, M. T. Remarkable blue shifts of C-H and N-H stretching frequencies in the interaction of monosubstituted formaldehyde and thioformaldehyde with nitrosyl hydride J. Phys. Chem. A 2009, 113, 3245-3253
-
(2009)
J. Phys. Chem. A
, vol.113
, pp. 3245-3253
-
-
Trung, N.T.1
Hue, T.T.2
Nguyen, M.T.3
-
26
-
-
79959402031
-
Intramolecular CH⋯O hydrogen bonds in the AI and BI DNA-like conformers of canonical nucleosides and their Watson-crick pairs. Quantum chemical and AIM analysis
-
Yurenko, Y. P.; Zhurakivsky, R. O.; Samijlenko, S. P.; Hovorun, D. M. Intramolecular CH⋯O hydrogen bonds in the AI and BI DNA-like conformers of canonical nucleosides and their Watson-crick pairs. Quantum chemical and AIM analysis J Biomol. Struc. Dynam. 2011, 29, 51-65
-
(2011)
J Biomol. Struc. Dynam.
, vol.29
, pp. 51-65
-
-
Yurenko, Y.P.1
Zhurakivsky, R.O.2
Samijlenko, S.P.3
Hovorun, D.M.4
-
27
-
-
79960884684
-
Defining the hydrogen bond: An account (IUPAC technical report) J
-
Arunan, E.; Desiraju, G. R.; Klein, R. A.; Sadlej, J.; Scheiner, S.; Alkorta, I.; Clary, D. C.; Crabtree, R. H.; Dannenberg, J. J.; Hobza, P.; Kjaergaard, H. G.; Legon, A. C.; Mennucci, B.; Nesbitt, D. Defining the hydrogen bond: An account (IUPAC technical report) J Pure Appl. Chem. 2011, 83, 1619-1636
-
(2011)
Pure Appl. Chem.
, vol.83
, pp. 1619-1636
-
-
Arunan, E.1
Desiraju, G.R.2
Klein, R.A.3
Sadlej, J.4
Scheiner, S.5
Alkorta, I.6
Clary, D.C.7
Crabtree, R.H.8
Dannenberg, J.J.9
Hobza, P.10
Kjaergaard, H.G.11
Legon, A.C.12
Mennucci, B.13
Nesbitt, D.14
-
28
-
-
0023898303
-
Attenuating organic contaminant mobility by soil modification
-
Boyd, S. A.; Lee, J.-F.; Mortland, M. M. Attenuating organic contaminant mobility by soil modification Nature 1988, 333, 345-347
-
(1988)
Nature
, vol.333
, pp. 345-347
-
-
Boyd, S.A.1
Lee, J.-F.2
Mortland, M.M.3
-
29
-
-
0000038240
-
Cationic surfactant adsorption by swelling and nonswelling layer silicates
-
Xu, S.; Boyd, S. A. Cationic surfactant adsorption by swelling and nonswelling layer silicates Langmuir 1995, 11, 2508-2514
-
(1995)
Langmuir
, vol.11
, pp. 2508-2514
-
-
Xu, S.1
Boyd, S.A.2
-
30
-
-
23844446079
-
Configurations of the bentonite-sorbed myristylpyridinium cation and their influences on the uptake of organic compounds
-
Chen, B.; Zhu, L.; Zhu, J. Configurations of the bentonite-sorbed myristylpyridinium cation and their influences on the uptake of organic compounds Environ. Sci. Technol. 2005, 39, 6093-6100
-
(2005)
Environ. Sci. Technol.
, vol.39
, pp. 6093-6100
-
-
Chen, B.1
Zhu, L.2
Zhu, J.3
-
31
-
-
0041815968
-
Interactions of organic contaminants with mineral-adsorbed surfactant
-
Zhu, L.; Chen, B.; Tao, S.; Chiou, C. T. Interactions of organic contaminants with mineral-adsorbed surfactant Environ. Sci. Technol. 2003, 37, 4001-4006
-
(2003)
Environ. Sci. Technol.
, vol.37
, pp. 4001-4006
-
-
Zhu, L.1
Chen, B.2
Tao, S.3
Chiou, C.T.4
-
32
-
-
79960960553
-
Sorptive characteristics of organomontmorillonite toward organic compounds: A combined LFERs and molecular dynamics simulation study
-
Zhu, R.; Chen, W.; Shapley, T. V.; Molinari, M.; Ge, F.; Parker, C. S. Sorptive characteristics of organomontmorillonite toward organic compounds: A combined LFERs and molecular dynamics simulation study Environ. Sci. Technol. 2011, 45, 6504-6510
-
(2011)
Environ. Sci. Technol.
, vol.45
, pp. 6504-6510
-
-
Zhu, R.1
Chen, W.2
Shapley, T.V.3
Molinari, M.4
Ge, F.5
Parker, C.S.6
-
33
-
-
61849159407
-
Predicting hydrogen-bond strengths from acid-base molecular properties. The pKa slide rule: Toward the solution of a long-lasting problem
-
Gilli, P.; Pretto, L.; Bertolasi, V.; Gilli, G. Predicting hydrogen-bond strengths from acid-base molecular properties. The pKa slide rule: Toward the solution of a long-lasting problem Acc. Chem. Res. 2009, 42, 33-44
-
(2009)
Acc. Chem. Res.
, vol.42
, pp. 33-44
-
-
Gilli, P.1
Pretto, L.2
Bertolasi, V.3
Gilli, G.4
-
35
-
-
0342292580
-
Raman spectral study of magnesium-solvent interaction in acetone solution
-
Lalic, M.; Antic-Jovanovic, A.; Jeremic, M.; Sasic, S. Raman spectral study of magnesium-solvent interaction in acetone solution Spectrosc. Lett. 1996, 29, 267-275
-
(1996)
Spectrosc. Lett.
, vol.29
, pp. 267-275
-
-
Lalic, M.1
Antic-Jovanovic, A.2
Jeremic, M.3
Sasic, S.4
-
36
-
-
77952511451
-
Ligand exchange dynamics in aqueous solution studied with 2DIR spectroscopy
-
Park, S.; Ji, M.; Gaffney, K. K. Ligand exchange dynamics in aqueous solution studied with 2DIR spectroscopy J. Phys. Chem. B 2010, 114, 6693-6702
-
(2010)
J. Phys. Chem. B
, vol.114
, pp. 6693-6702
-
-
Park, S.1
Ji, M.2
Gaffney, K.K.3
-
37
-
-
84875769733
-
Cations bind only weakly to amides in aqueous solutions
-
Okur, H. I.; Kherb, J.; Cremer, P. S. Cations bind only weakly to amides in aqueous solutions J. Am. Chem. Soc. 2013, 135, 5062-5067
-
(2013)
J. Am. Chem. Soc.
, vol.135
, pp. 5062-5067
-
-
Okur, H.I.1
Kherb, J.2
Cremer, P.S.3
-
38
-
-
38049115321
-
- symporter (NIS) mediates electroneutral active transport of the environmental pollutant perchlorate
-
- symporter (NIS) mediates electroneutral active transport of the environmental pollutant perchlorate Proc. Natl. Acad. Sci. U.S.A. 2007, 104, 20250-20255
-
(2007)
Proc. Natl. Acad. Sci. U.S.A.
, vol.104
, pp. 20250-20255
-
-
Dohan, O.1
Portulano, C.2
Basquin, C.3
Reyna-Neyra, A.4
Amzel, L.M.5
Carrasco, N.6
-
39
-
-
79958861713
-
Modulation of thyroid hormone concentrations in serum of rats coadministered with perchlorate and iodide-deficient diet
-
Kunisue, T.; Fisher, J. W.; Kannan, K. Modulation of thyroid hormone concentrations in serum of rats coadministered with perchlorate and iodide-deficient diet Arch. Environ. Contam. Toxicol. 2011, 61, 151-158
-
(2011)
Arch. Environ. Contam. Toxicol.
, vol.61
, pp. 151-158
-
-
Kunisue, T.1
Fisher, J.W.2
Kannan, K.3
-
40
-
-
79959230270
-
The effects of perchlorate on thyroidal gene expression are different from the effects of iodide deficiency
-
McDougal, J. N.; Jones, K. L.; Fatuyi, B.; Gray, K. J.; Blount, B. C.; Valentin-Blasini, L.; Fisher, J. W. The effects of perchlorate on thyroidal gene expression are different from the effects of iodide deficiency J. Toxicol. Environ. Health A 2011, 74, 917-926
-
(2011)
J. Toxicol. Environ. Health A
, vol.74
, pp. 917-926
-
-
McDougal, J.N.1
Jones, K.L.2
Fatuyi, B.3
Gray, K.J.4
Blount, B.C.5
Valentin-Blasini, L.6
Fisher, J.W.7
-
41
-
-
84865733666
-
Nature of the interlayer environment in an organoclay optimized for the sequestration of dibenzo-p-dioxin
-
Johnston, C. T.; Khan, B.; Barth, E. F.; Chattopadhyay, S.; Boyd, S. A. Nature of the interlayer environment in an organoclay optimized for the sequestration of dibenzo-p-dioxin Environ. Sci. Technol. 2012, 46, 9584-9597
-
(2012)
Environ. Sci. Technol.
, vol.46
, pp. 9584-9597
-
-
Johnston, C.T.1
Khan, B.2
Barth, E.F.3
Chattopadhyay, S.4
Boyd, S.A.5
-
42
-
-
31144431582
-
Blue shift in X-H stretching frequency of molecules due to confinement
-
Shameema, O.; Ramachandran, C. N.; Sathyamurthy, N. Blue shift in X-H stretching frequency of molecules due to confinement J. Phys. Chem. A 2006, 110, 2-4
-
(2006)
J. Phys. Chem. A
, vol.110
, pp. 2-4
-
-
Shameema, O.1
Ramachandran, C.N.2
Sathyamurthy, N.3
-
43
-
-
0001178171
-
Quantum chemistry of confined systems: Structure and vibronic spectra of a confined hydrogen molecule
-
Bielinska-Waz, D.; Diercksen, G. H. F.; Klobukowski, M. Quantum chemistry of confined systems: Structure and vibronic spectra of a confined hydrogen molecule Chem. Phys. Lett. 2001, 349, 215-219
-
(2001)
Chem. Phys. Lett.
, vol.349
, pp. 215-219
-
-
Bielinska-Waz, D.1
Diercksen, G.H.F.2
Klobukowski, M.3
-
44
-
-
13344282706
-
The ionic hydrogen bond
-
Mautner, M. The ionic hydrogen bond Chem. Rev. 2005, 105, 213-284
-
(2005)
Chem. Rev.
, vol.105
, pp. 213-284
-
-
Mautner, M.1
-
45
-
-
29144474180
-
Evidence for a blue-shifting intramolecular hydrogen bond in the vibrational overtone spectrum of 1H-nonafluorobutane
-
Saar, B. G.; O'Donoghue, G. P.; Steeves, A. H.; Thoman, J. W., Jr. Evidence for a blue-shifting intramolecular hydrogen bond in the vibrational overtone spectrum of 1H-nonafluorobutane Chem. Phy. Lett. 2006, 417, 159-163
-
(2006)
Chem. Phy. Lett.
, vol.417
, pp. 159-163
-
-
Saar, B.G.1
O'Donoghue, G.P.2
Steeves, A.H.3
Thoman, Jr.J.W.4
-
47
-
-
0035280777
-
Conformation of methylene chains in an intercalated surfactant bilayer
-
Venkataraman, N. V.; Vasudevan, S. Conformation of methylene chains in an intercalated surfactant bilayer J. Phys. Chem. B 2001, 105, 1805-1812
-
(2001)
J. Phys. Chem. B
, vol.105
, pp. 1805-1812
-
-
Venkataraman, N.V.1
Vasudevan, S.2
-
48
-
-
47049094266
-
Regulating function of methyl group in strength of CH⋯O hydrogen bond: A high-level ab initio study
-
Li, Q.; An, X.; Luan, F.; Li, W.; Gong, B.; Cheng, J. Regulating function of methyl group in strength of CH⋯O hydrogen bond: A high-level ab initio study J. Phys. Chem. A 2008, 112, 3985-3990
-
(2008)
J. Phys. Chem. A
, vol.112
, pp. 3985-3990
-
-
Li, Q.1
An, X.2
Luan, F.3
Li, W.4
Gong, B.5
Cheng, J.6
-
50
-
-
0042733489
-
2 droplets using Raman spectroscopy
-
2 droplets using Raman spectroscopy J. Phys. Chem. A 2003, 107, 5956-5962
-
(2003)
J. Phys. Chem. A
, vol.107
, pp. 5956-5962
-
-
Zhang, Y.1
Chan, C.K.2
-
51
-
-
0037073150
-
Substituent effects on the blue-shifted hydrogen bonds
-
Fan, J.-M.; Liu, L.; Guo, Q.-X. Substituent effects on the blue-shifted hydrogen bonds Chem. Phys. Lett. 2002, 365, 464-472
-
(2002)
Chem. Phys. Lett.
, vol.365
, pp. 464-472
-
-
Fan, J.-M.1
Liu, L.2
Guo, Q.-X.3
-
53
-
-
80855140368
-
Ab initio investigation of the hydration of the tetrahedral perchlorate, perbromate, selenate, arsenate, and vanadate anions
-
Pye, C. C.; Walker, V. E. J. Ab initio investigation of the hydration of the tetrahedral perchlorate, perbromate, selenate, arsenate, and vanadate anions J. Phys, Chem. A 2011, 115, 13007-13015
-
(2011)
J. Phys, Chem. A
, vol.115
, pp. 13007-13015
-
-
Pye, C.C.1
Walker, V.E.J.2
-
55
-
-
0000995427
-
Short, strong hydrogen bonds in the gas phase and in solution: Theoretical exploration of pKa matching and environmental effects on the strengths of hydrogen bonds and their potential roles in enzymatic catalysis
-
Chen, J.; McAllister, M. A.; Lee, J. K.; Houk, K. N. Short, strong hydrogen bonds in the gas phase and in solution: Theoretical exploration of pKa matching and environmental effects on the strengths of hydrogen bonds and their potential roles in enzymatic catalysis J. Org. Chem. 1998, 63, 4611-4619
-
(1998)
J. Org. Chem.
, vol.63
, pp. 4611-4619
-
-
Chen, J.1
McAllister, M.A.2
Lee, J.K.3
Houk, K.N.4
-
56
-
-
84962477135
-
Characterization of low-barrier hydrogen bonds. 6. Cavity polarity effects on the formic acid-formate anion model system. An ab initio and DFT investigation
-
Pan, Y.; McAllister, M. A. Characterization of low-barrier hydrogen bonds. 6. Cavity polarity effects on the formic acid-formate anion model system. An ab initio and DFT investigation J. Am. Chem. Soc. 1998, 120, 166-169
-
(1998)
J. Am. Chem. Soc.
, vol.120
, pp. 166-169
-
-
Pan, Y.1
McAllister, M.A.2
-
57
-
-
84863489479
-
Effect of hydrogen bonds on pKa values: Importance of networking
-
Shokri, A.; Abedin, A.; Fattahi, A.; Kass, S. R. Effect of hydrogen bonds on pKa values: Importance of networking J. Am. Chem. Soc. 2012, 134, 10646-10650
-
(2012)
J. Am. Chem. Soc.
, vol.134
, pp. 10646-10650
-
-
Shokri, A.1
Abedin, A.2
Fattahi, A.3
Kass, S.R.4
-
58
-
-
33646346580
-
Environmental perchlorate: Why it matters
-
Kirk, A. Environmental perchlorate: Why it matters Anal. Chim. Acta 2006, 567, 4-12
-
(2006)
Anal. Chim. Acta
, vol.567
, pp. 4-12
-
-
Kirk, A.1
-
60
-
-
0034679011
-
How strong is the C-H-C hydrogen bond?
-
Vargas, R.; Garza, J.; Dixon, D. A.; Hay, B. P. How strong is the C-H-C hydrogen bond? J. Am. Chem. Soc. 2000, 122, 4750-4755
-
(2000)
J. Am. Chem. Soc.
, vol.122
, pp. 4750-4755
-
-
Vargas, R.1
Garza, J.2
Dixon, D.A.3
Hay, B.P.4
|