-
1
-
-
19744370478
-
The remarkable basicity of 1, 8-bis(dimethylamino)naphthalene
-
R.W. Alder et al., The remarkable basicity of 1, 8-bis(dimethylamino) naphthalene, J. Chem. Soc. Chem. Commun. 723-724 (1968)
-
(1968)
J. Chem. Soc. Chem. Commun.
, pp. 723-724
-
-
Alder, R.W.1
-
2
-
-
84890251387
-
Aldrich chemical, sigma-aldrich
-
Aldrich Chemicals, Sigma-Aldrich, Handbook of Fine Chemicals, 2007-2008
-
(2007)
Handbook of Fine Chemicals
-
-
-
3
-
-
84990134893
-
Proton sponges and the geometry of hydrogen bonds: Aromatic nitrogen bases with exceptional basicities
-
H.A. Staab, T. Saupe, Proton sponges and the geometry of hydrogen bonds: aromatic nitrogen bases with exceptional basicities. Angew. Chem. Int. Ed. Engl. 27, 865-1008 (1988)
-
(1988)
Angew. Chem. Int. Ed. Engl
, vol.27
, pp. 865-1008
-
-
Staab, H.A.1
Saupe, T.2
-
4
-
-
84890244426
-
Strain effects on amine basicities
-
R.W. Alder, Strain effects on amine basicities. Chem. Rev. 69, 1215-1233 (1985)
-
(1985)
Chem. Rev
, vol.69
, pp. 1215-1233
-
-
Alder, R.W.1
-
5
-
-
0002852857
-
Naphthalene proton sponges (naftalinovye protonnye gubki)
-
A.F. Pozharskii, Naphthalene proton sponges (naftalinovye protonnye gubki). Usp. Khim. 67, 3-27 (1998)
-
(1998)
Usp. Khim
, vol.67
, pp. 3-27
-
-
Pozharskii, A.F.1
-
6
-
-
77956715871
-
Hydrogen bonding and chemical reactivity
-
F. Hibbert, J. Emsley, Hydrogen bonding and chemical reactivity. Adv. Phys. Org. Chem. 26, 255-379 (1991)
-
(1991)
Adv. Phys. Org. Chem
, vol.26
, pp. 255-379
-
-
Hibbert, F.1
Emsley, J.2
-
7
-
-
0039893753
-
Proton sponges
-
A.L. Llamas-Saiz et al., Proton sponges. J. Mol. Struct. 328, 297-323 (1994)
-
(1994)
J. Mol. Struct
, vol.328
, pp. 297-323
-
-
Llamas-Saiz, A.L.1
-
8
-
-
0037051762
-
X-ray diffraction and IR-spectroscopic studies on protonated 4-amino-1, 8-bis(dimethylamino) naphthalene
-
V.A. Ozeryanskii et al., X-ray diffraction and IR-spectroscopic studies on protonated 4-amino-1, 8-bis(dimethylamino) naphthalene. J. Mol. Struct. 607, 1-8 (2002)
-
(2002)
J. Mol. Struct
, vol.607
, pp. 1-8
-
-
Ozeryanskii, V.A.1
-
9
-
-
0040714132
-
On consequences of protonation of diamines in the gas phase and the solid state
-
K. Wozniak et al., On consequences of protonation of diamines in the gas phase and the solid state. Isr. J. Chem. 39, 245-252 (1999)
-
(1999)
Isr. J. Chem
, vol.39
, pp. 245-252
-
-
Wozniak, K.1
-
11
-
-
0346992393
-
Organometallic synthesis, molecular structure, and coloration of 2, 7-disubstituted 1, 8-bis(dimethylamino)naphthalenes. how significant is the influence of "buttressing effect" on their basicity?
-
A.F. Pozharskii et al., Organometallic synthesis, molecular structure, and coloration of 2, 7-disubstituted 1, 8-bis(dimethylamino)naphthalenes. how significant is the influence of "buttressing effect" on their basicity? J. Org. Chem. 68, 10109-10122 (2003)
-
(2003)
J. Org. Chem
, vol.68
, pp. 10109-10122
-
-
Pozharskii, A.F.1
-
12
-
-
26844564728
-
Softness of hydrogen bond interaction
-
L. Sobczyk, Softness of hydrogen bond interaction. Khim. Fiz. 24, 1-8 (2005)
-
(2005)
Khim. Fiz
, vol.24
, pp. 1-8
-
-
Sobczyk, L.1
-
13
-
-
49549142239
-
+ hydrogen bonding in homoconjugated polycations of triethy-lenediamine perchlorate
-
+ hydrogen bonding in homoconjugated polycations of triethy-lenediamine perchlorate. Chem. Phys. Lett. 36, 106-107 (1975)
-
(1975)
Chem. Phys. Lett
, vol.36
, pp. 106-107
-
-
Głowiak, T.1
-
14
-
-
36749105180
-
A strong asymmetric N-H-N hydrogen bond: Neutron diffraction and IR spectroscopic studies of 4-aminopyridine hemiperchlorate
-
J. Roziere et al., A strong asymmetric N-H-N hydrogen bond: Neutron diffraction and IR spectroscopic studies of 4-aminopyridine hemiperchlorate. J. Chem. Phys. 72, 6117-6122 (1980)
-
(1980)
J. Chem. Phys
, vol.72
, pp. 6117-6122
-
-
Roziere, J.1
-
15
-
-
37049101776
-
A strong symmetrical N-H-N bond. A 120 Kneutron diffraction study of hydrogen diquinuclidinone perchlorate
-
J. Roziere et al., A strong symmetrical N-H-N bond. A 120 Kneutron diffraction study of hydrogen diquinuclidinone perchlorate, J. Chem. Soc. Chem. Commun. 388-389 (1982)
-
(1982)
J. Chem. Soc. Chem. Commun.
, pp. 388-389
-
-
Roziere, J.1
-
16
-
-
37049105677
-
Intrabridgehead hydrogen-bonded ions: Spectroscopic characteristics and the question of single vs double minimum potentials
-
R.W. Alder et al., Intrabridgehead hydrogen-bonded ions: spectroscopic characteristics and the question of single vs double minimum potentials, J. Chem. Soc. Chem. Commun. 1000-1003 (1983)
-
(1983)
J. Chem. Soc. Chem. Commun.
, pp. 1000-1003
-
-
Alder, R.W.1
-
17
-
-
14844366604
-
+Hydrogen bonding in protonated 1, 8-bis(dimethylamino)- 2, 7-dimethoxynaphthalene X-ray diffraction, infrared, and theoretical ab initio and dft studies
-
+Hydrogen bonding in protonated 1, 8-bis(dimethylamino)-2, 7-dimethoxynaphthalene. X-ray diffraction, infrared, and theoretical ab initio and dft studies. J. Phys. Chem. A 109, 1637-1642 (2005)
-
(2005)
J. Phys. Chem. A
, vol.109
, pp. 1637-1642
-
-
Ozeryanskii, V.A.1
-
18
-
-
0000243506
-
Structure and IR spectroscopic behaviour of 2, 7-dichloro-1, 8-bis(dimethy-lamino)naphthalene and its protonated form
-
T. Głowiak et al., Structure and IR spectroscopic behaviour of 2, 7-dichloro-1, 8-bis(dimethy-lamino)naphthalene and its protonated form. J. Phys. Org. Chem. 12, 895-900 (1999)
-
(1999)
J. Phys. Org. Chem
, vol.12
, pp. 895-900
-
-
Głowiak, T.1
-
19
-
-
0042882332
-
Low barrier hydrogen bond in protonated proton sponge, X-ray diffraction, infrared, and theoretical ab initio density functional theory studies
-
A.J. Bieńko et al., Low barrier hydrogen bond in protonated proton sponge. X-ray diffraction, infrared, and theoretical ab initio density functional theory studies. J. Chem. Phys. 119, 4313-4319 (2003)
-
(2003)
J. Chem. Phys
, vol.119
, pp. 4313-4319
-
-
Bieńko, A.J.1
-
20
-
-
44349166817
-
2, 7-Disubstituted proton sponges as borderline systems for investigating barrier-free intramolecular hydrogen bonds, Protonated 2, 7-bis(trimethylsilyl) -and 2, 7-di (hydroxymethyl)-1, 8-bis(dimethylamino)naphthalenes
-
A.V. Degtyarev et al., 2, 7-Disubstituted proton sponges as borderline systems for investigating barrier-free intramolecular hydrogen bonds. Protonated 2, 7-bis(trimethylsilyl)-and 2, 7-di (hydroxymethyl)-1, 8-bis(dimethylamino) naphthalenes. Tetrahedron 64, 6209-6224 (2008)
-
(2008)
Tetrahedron
, vol.64
, pp. 6209-6224
-
-
Degtyarev, A.V.1
-
21
-
-
0002947465
-
Protonation of very strong bases by phenols in non-aqueous solutions
-
B. Brzezinski et al., Protonation of very strong bases by phenols in non-aqueous solutions, J. Chem. Res. (M) 1021-1040 (1997)
-
(1997)
J. Chem. Res. (M)
, pp. 1021-1040
-
-
Brzezinski, B.1
-
22
-
-
0000376330
-
+ hydrogen bonding in salts of bis(dimethylaminomethyl) naphthalene (DMAMN)
-
+ hydrogen bonding in salts of bis(dimethylaminomethyl) naphthalene (DMAMN). J. Mol. Struct. 356, 117-124 (1995)
-
(1995)
J. Mol. Struct
, vol.356
, pp. 117-124
-
-
Sawka-Dobrowolska, W.1
-
23
-
-
34848837970
-
4 salts of 1, 8-bis(dimethylamino) naphthalene derivatives
-
4 salts of 1, 8-bis(dimethylamino) naphthalene derivatives. J. Phys. Org. Chem. 20, 643-648 (2007)
-
(2007)
J. Phys. Org. Chem
, vol.20
, pp. 643-648
-
-
Chmielewski, P.1
-
24
-
-
84890153702
-
Potential energy shape for the proton motion in hydrogen bond reflected in infrared and NMR spectra
-
ed. by S.J. Grabowski, Springer, Dordrecht
-
G.S. Denisov et al., Potential energy shape for the proton motion in hydrogen bond reflected in infrared and NMR spectra, in Hydrogen Bonding-New Insights, ed. by S.J. Grabowski (Springer, Dordrecht, 2006), p. 377
-
(2006)
Hydrogen Bonding-New Insights
, pp. 377
-
-
Denisov, G.S.1
-
25
-
-
84979940309
-
Vibrational isotope effects in hydrogen bonds
-
ed. by A. Kohen, H.-H. Limbach, Taylor & Francis, Boca Raton, FL
-
Z. Mielke, L. Sobczyk, Vibrational isotope effects in hydrogen bonds, in Isotope Effects in Chemistry and Biology, ed. by A. Kohen, H.-H. Limbach (Taylor & Francis, Boca Raton, FL, 2006), pp. 281-304
-
(2006)
Isotope Effects in Chemistry and Biology
, pp. 281-304
-
-
Mielke, Z.1
Sobczyk, L.2
-
28
-
-
0035002930
-
Application of the deuterium isotope effect on nmr chemical shift to study proton transfer equilibrium
-
T. Dziembowska, Z. Rozwadowski, Application of the deuterium isotope effect on nmr chemical shift to study proton transfer equilibrium. Curr. Org. Chem. 5, 289-313 (2001)
-
(2001)
Curr. Org. Chem
, vol.5
, pp. 289-313
-
-
Dziembowska, T.1
Rozwadowski, Z.2
-
29
-
-
0001593634
-
The composition, structure and hydrogen bonding of the b-diketones
-
J. Emsley, The composition, structure and hydrogen bonding of the b-diketones. Struct. Bonding 57, 147-191 (1984)
-
(1984)
Struct. Bonding
, vol.57
, pp. 147-191
-
-
Emsley, J.1
-
30
-
-
0001808536
-
Note on isotope effect in hydrogen bonded crystals
-
E. Matsushita, T. Matsubara, Note on isotope effect in hydrogen bonded crystals. Progr. Theoret. Phys. 67, 1-19 (1982)
-
(1982)
Progr. Theoret. Phys
, vol.67
, pp. 1-19
-
-
Matsushita, E.1
Matsubara, T.2
-
31
-
-
18544366221
-
1H chemical shifts of proton sponges
-
1H chemical shifts of proton sponges. J. Mol. Struct. 615, 121-140 (2002)
-
(2002)
J. Mol. Struct
, vol.615
, pp. 121-140
-
-
Grech, E.1
-
32
-
-
0002395403
-
Proton and deuterium NMR of hydrogen bonds: Relationship between isotope effects and the hydrogen bond potential
-
G. Gunnarsson et al., Proton and deuterium NMR of hydrogen bonds: relationship between isotope effects and the hydrogen bond potential. Chem. Phys. Lett. 38, 96-99 (1976)
-
(1976)
Chem. Phys. Lett
, vol.38
, pp. 96-99
-
-
Gunnarsson, G.1
-
34
-
-
0141757141
-
NN a reliable indicator of N-N distance? Chem
-
NN a reliable indicator of N-N distance? Chem. Eur. J. 9, 4523-4535 (2003)
-
(2003)
Eur. J
, vol.9
, pp. 4523-4535
-
-
Lloyd-Jones, G.C.1
-
35
-
-
0034800444
-
13C detected scalar nitrogen-nitrogen couplings across the intramolecular symmetric NHN hydrogen bond of proton sponge
-
13C detected scalar nitrogen-nitrogen couplings across the intramolecular symmetric NHN hydrogen bond of proton sponge. J. Am. Chem. Soc. 123, 4338-4339 (2001)
-
(2001)
J. Am. Chem. Soc
, vol.123
, pp. 4338-4339
-
-
Pietrzak, M.1
-
37
-
-
0032034294
-
15N NMR and theoretical studies of primary and secondary geometric h/d isotope effects on low-barrier nhn-hydrogen bonds
-
15N NMR and theoretical studies of primary and secondary geometric h/d isotope effects on low-barrier nhn-hydrogen bonds. J. Am. Chem. Soc. 120, 2939-2950 (1998)
-
(1998)
J. Am. Chem. Soc
, vol.120
, pp. 2939-2950
-
-
Benedict, H.1
-
38
-
-
38849188600
-
15N coupling constant across an NHN hydrogen bond
-
15N coupling constant across an NHN hydrogen bond. Angew. Chem. Int. Ed. 47, 1123-1126 (2008)
-
(2008)
Angew. Chem. Int. Ed
, vol.47
, pp. 1123-1126
-
-
Pietrzak, M.1
-
39
-
-
0036498491
-
Numerical solving of the vibrational time-independent Schroedinger equation in one and two dimensions using the variational method
-
J. Stare, J. Mavri, Numerical solving of the vibrational time-independent Schroedinger equation in one and two dimensions using the variational method. J. Comput. Phys. Commun. 143, 222-240 (2002)
-
(2002)
J. Comput. Phys. Commun
, vol.143
, pp. 222-240
-
-
Stare, J.1
Mavri, J.2
-
40
-
-
9444294069
-
Theoretical studies of hydrogen bonding
-
P. Hobza, Theoretical studies of hydrogen bonding. Annu. Rep. Prog. Chem., Sec. C 100, 3-27 (2004)
-
(2004)
Annu. Rep. Prog. Chem. Sec. C
, vol.100
, pp. 3-27
-
-
Hobza, P.1
-
42
-
-
0002599819
-
Predicting proton transfer barriers with density functional theory
-
S. Sadhukhan et al., Predicting proton transfer barriers with density functional theory. Chem. Phys. Lett. 306, 83-87 (1999)
-
(1999)
Chem. Phys. Lett
, vol.306
, pp. 83-87
-
-
Sadhukhan, S.1
-
45
-
-
84890240711
-
-
K.Mierzwicki, Z.Latajka, to be published
-
K.Mierzwicki, Z.Latajka, to be published
-
-
-
-
47
-
-
77249127120
-
Benchmark databases for nonbonded interactions and their use to test density functional theory
-
Z. Zhao, D.G. Truhlar, Benchmark databases for nonbonded interactions and their use to test density functional theory. J. Chem. Theory Comput. 1, 415-432 (2005)
-
(2005)
J. Chem. Theory Comput
, vol.1
, pp. 415-432
-
-
Zhao, Z.1
Truhlar, D.G.2
-
48
-
-
35748980308
-
General performance of density functionals
-
S.F. Sousa et al., General performance of density functionals. J. Phys. Chem. A 111, 10439-10452 (2007)
-
(2007)
J. Phys. Chem. A
, vol.111
, pp. 10439-10452
-
-
Sousa, S.F.1
-
49
-
-
40549127108
-
Density functionals with broad applicability in chemistry
-
Y. Zhao, D.G. Truhlar, Density functionals with broad applicability in chemistry. Acc. Chem. Res. 41, 157-167 (2008)
-
(2008)
Acc. Chem. Res
, vol.41
, pp. 157-167
-
-
Zhao, Y.1
Truhlar, D.G.2
-
50
-
-
0001356079
-
Density functional theory applied to proton transfer systems: A numerical test
-
C. Mijoule et al., Density functional theory applied to proton transfer systems: a numerical test. Chem. Phys. Lett. 208, 364-368 (1993)
-
(1993)
Chem. Phys. Lett
, vol.208
, pp. 364-368
-
-
Mijoule, C.1
-
52
-
-
0001451394
-
Proton transfer in model hydrogen-bonded systems by a density functional approach
-
V. Barone et al., Proton transfer in model hydrogen-bonded systems by a density functional approach. Chem. Phys. Lett 231, 295-300 (1994)
-
(1994)
Chem. Phys. Lett
, vol.231
, pp. 295-300
-
-
Barone, V.1
-
53
-
-
0000491838
-
+ gas phase clusters based on density functional theory
-
+ gas phase clusters based on density functional theory. Mol. Phys. 91, 963-975 (1997)
-
(1997)
Mol. Phys
, vol.91
, pp. 963-975
-
-
Termath, V.1
Sauer, J.2
-
54
-
-
5644275141
-
Exploring the potential energy surface for proton transfer in acetylacetone
-
I. Matanović et al., Exploring the potential energy surface for proton transfer in acetylacetone. Chem. Phys. 306, 201-207 (2004)
-
(2004)
Chem. Phys
, vol.306
, pp. 201-207
-
-
Matanović, I.1
-
55
-
-
0035890196
-
Electron correlation and basis set effects on strong hydrogen bond behaviour: A case study on the hydrogen difluoride anion
-
S. Kawahara et al., Electron correlation and basis set effects on strong hydrogen bond behaviour: a case study on the hydrogen difluoride anion. Chem. Phys. 273, 207-216 (2001)
-
(2001)
Chem. Phys
, vol.273
, pp. 207-216
-
-
Kawahara, S.1
-
56
-
-
84890021933
-
The calculation of small molecular interactions by the difference of separate total energies. Some procedures with reduced errors
-
S.F. Boys, F. Bernardi, The calculation of small molecular interactions by the difference of separate total energies. Some procedures with reduced errors. Mol. Phys. 19, 553-566 (1970)
-
(1970)
Mol. Phys
, vol.19
, pp. 553-566
-
-
Boys, S.F.1
Bernardi, F.2
-
57
-
-
0001419573
-
Basis set superposition error in proton transfer potentials
-
Z. Latajka et al., Basis set superposition error in proton transfer potentials. Chem. Phys. Lett. 196, 384-389 (1992)
-
(1992)
Chem. Phys. Lett
, vol.196
, pp. 384-389
-
-
Latajka, Z.1
-
58
-
-
0011610688
-
Site-site function and successive reaction counterpoise calculation of basis set superposition error for proton transfer
-
A.J. Abkowicz et al., Site-site function and successive reaction counterpoise calculation of basis set superposition error for proton transfer. J. Mol. Struct. (THEOCHEM) 342, 53-159 (1995)
-
(1995)
J. Mol. Struct. (THEOCHEM)
, vol.342
, pp. 53-159
-
-
Abkowicz, A.J.1
-
59
-
-
0000678715
-
Van der Waals interaction potentials: Many-body basis set superposition effects
-
H. Wells, S. Wilson, Van der Waals interaction potentials: many-body basis set superposition effects. Chem. Phys. Lett. 101, 429-434 (1983)
-
(1983)
Chem. Phys. Lett
, vol.101
, pp. 429-434
-
-
Wells, H.1
Wilson, S.2
-
60
-
-
0142170064
-
Combined bond-polarization basis sets for accurate determination of dissociation energies. Part 3. Basis set superposition error in polyatomic systems
-
J.M.L. Martin et al., Combined bond-polarization basis sets for accurate determination of dissociation energies. Part 3. Basis set superposition error in polyatomic systems. Theor. Chim. Acta 76, 195-209 (1989)
-
(1989)
Theor. Chim. Acta
, vol.76
, pp. 195-209
-
-
Martin, J.M.L.1
-
61
-
-
0141925282
-
Three-fragment counterpoise correction of potential energy curves for proton-transfer recations
-
A. Ponti, M. Mella, Three-fragment counterpoise correction of potential energy curves for proton-transfer recations. J. Phys. Chem. A 107, 7589-7596 (2003)
-
(2003)
J. Phys. Chem. A
, vol.107
, pp. 7589-7596
-
-
Ponti, A.1
Mella, M.2
|