-
2
-
-
4243661738
-
-
10.1016/0371-1951(59)80229-0
-
DN Shigorin 1959 Spectrochim Acta 14 169 179 10.1016/0371-1951(59)80229-0
-
(1959)
Spectrochim Acta
, vol.14
, pp. 169-179
-
-
Shigorin, D.N.1
-
4
-
-
0000475186
-
-
10.1021/j100573a015 1:CAS:528:DyaE2MXhtlWntbc%3D
-
BS Ault GC Pimentel 1975 J Phys Chem 79 621 626 10.1021/j100573a015 1:CAS:528:DyaE2MXhtlWntbc%3D
-
(1975)
J Phys Chem
, vol.79
, pp. 621-626
-
-
Ault, B.S.1
Pimentel, G.C.2
-
5
-
-
0000001379
-
π-systems as lithium/hydrogen bond acceptors: Some theoretical observations
-
DOI 10.1063/1.477651, PII S0021960698306467
-
SSC Ammal P Venuvanalingam 1998 J Chem Phys 109 9820 9830 10.1063/1.477651 1:CAS:528:DyaK1cXnsVKqsb4%3D (Pubitemid 128678412)
-
(1998)
Journal of Chemical Physics
, vol.109
, Issue.22
, pp. 9820-9830
-
-
Ammal, S.S.C.1
Venuvanalingam, P.2
-
6
-
-
0000241345
-
-
10.1063/1.474773 1:CAS:528:DyaK2sXlvVens7o%3D
-
SSC Ammal P Venuvanalingam 1997 J Chem Phys 107 4329 4336 10.1063/1.474773 1:CAS:528:DyaK2sXlvVens7o%3D
-
(1997)
J Chem Phys
, vol.107
, pp. 4329-4336
-
-
Ammal, S.S.C.1
Venuvanalingam, P.2
-
9
-
-
0000736269
-
Schleyer PvR
-
10.1021/cr00104a007 1:CAS:528:DyaK3cXlsFanurY%3D
-
AB Sannigrahi T Kar BG Niyogi P Hobza 1990 Schleyer PvR Chem Rev 90 1061 1076 10.1021/cr00104a007 1:CAS:528:DyaK3cXlsFanurY%3D
-
(1990)
Chem Rev
, vol.90
, pp. 1061-1076
-
-
Sannigrahi, A.B.1
Kar, T.2
Niyogi, B.G.3
Hobza, P.4
-
11
-
-
33745878272
-
-
10.1016/j.chemphys.2006.02.032 1:CAS:528:DC%2BD28XntVWhs78%3D
-
A Vila E Vila RA Mosquera 2006 Chem Phys 326 401 408 10.1016/j.chemphys. 2006.02.032 1:CAS:528:DC%2BD28XntVWhs78%3D
-
(2006)
Chem Phys
, vol.326
, pp. 401-408
-
-
Vila, A.1
Vila, E.2
Mosquera, R.A.3
-
12
-
-
0342854451
-
Origin and nature of lithium and hydrogen bonds to oxygen, sulfur, and selenium
-
DOI 10.1021/jp001283k
-
SSC Ammal P Venuvanalingam S Paul 2000 J Chem Phys 104 10859 10864 10.1021/jp001283k 1:CAS:528:DC%2BD3cXns1anurg%3D (Pubitemid 32023524)
-
(2000)
Journal of Physical Chemistry A
, vol.104
, Issue.46
, pp. 10859-10867
-
-
Salai Cheettu Ammal, S.1
Venuvanalingam, P.2
-
13
-
-
23944450616
-
Van der Waals interactions in aromatic systems: Structure and energetics of dimers and trimers of pyridine
-
DOI 10.1002/cphc.200500100
-
M Piacenza S Grimme 2005 Chem Phys Chem 6 1554 1558 10.1002/cphc. 200500100 1:CAS:528:DC%2BD2MXps12ntLo%3D (Pubitemid 41187237)
-
(2005)
ChemPhysChem
, vol.6
, Issue.8
, pp. 1554-1558
-
-
Piacenza, M.1
Grimme, S.2
-
14
-
-
77953480956
-
-
10.1007/s00214-009-0713-y 1:CAS:528:DC%2BC3cXmvFOgtb8%3D
-
M Caffarel A Scemama A Ramírez-Solís 2010 Theor Chem Acc 126 275 287 10.1007/s00214-009-0713-y 1:CAS:528:DC%2BC3cXmvFOgtb8%3D
-
(2010)
Theor Chem Acc
, vol.126
, pp. 275-287
-
-
Caffarel, M.1
Scemama, A.2
Ramírez-Solís, A.3
-
15
-
-
0034317690
-
Molecular clusters of π-systems: Theoretical studies of structures, spectra, and origin of interaction energies
-
DOI 10.1021/cr990051i
-
KS Kim PJ Tarakeshwar Y Lee 2000 Chem Rev 100 4145 4185 10.1021/cr990051i 1:CAS:528:DC%2BD3cXmslGjtbw%3D (Pubitemid 32067770)
-
(2000)
Chemical Reviews
, vol.100
, Issue.11
, pp. 4145-4185
-
-
Kim, K.S.1
Tarakeshwar, P.2
Lee, J.Y.3
-
18
-
-
0004226987
-
-
2 Benjamin Cummings Menlo Park
-
Loudon GM (1988) Organic Chemistry, 2nd edn. Benjamin Cummings, Menlo Park
-
(1988)
Organic Chemistry
-
-
Loudon, G.M.1
-
19
-
-
37049069283
-
-
10.1039/cs9871600467 1:CAS:528:DyaL1cXkt1Oksrg%3D
-
AC Legon DJ Millen 1987 Chem Soc Rev 16 467 498 10.1039/cs9871600467 1:CAS:528:DyaL1cXkt1Oksrg%3D
-
(1987)
Chem Soc Rev
, vol.16
, pp. 467-498
-
-
Legon, A.C.1
Millen, D.J.2
-
20
-
-
0033578736
-
Prereactive complexes of dihalogens XY with Lewis bases B in the gas phase: A systematic case for the halogen analogue B···XY of the hydrogen bond B···HX
-
DOI 10.1002/(SICI)1521-3773(19990917)38:18<2686::AID-ANIE2686>3.0. CO;2-6
-
AC Legon 1999 Angew Chem Int Ed 38 2686 2714 10.1002/(SICI)1521- 3773(19990917)38:18<2686::AID-ANIE2686>3.0.CO;2-6 (Pubitemid 29462830)
-
(1999)
Angewandte Chemie - International Edition
, vol.38
, Issue.18
, pp. 2686-2714
-
-
Legon, A.C.1
-
22
-
-
0000534646
-
-
10.1063/1.445178 1:CAS:528:DyaL3sXhsFajtL4%3D
-
JA Shea SG Kukolich 1983 J Chem Phys 78 3545 3551 10.1063/1.445178 1:CAS:528:DyaL3sXhsFajtL4%3D
-
(1983)
J Chem Phys
, vol.78
, pp. 3545-3551
-
-
Shea, J.A.1
Kukolich, S.G.2
-
23
-
-
18544410893
-
Are members of the family of hydrogen-bonded complexes formed by furan with the hydrogen halides isostructural? An answer from the rotational spectrum of furan...HBr
-
DOI 10.1063/1.1488920
-
GC Cole AC Legon P Ottaviani 2002 J Chem Phys 117 2790 2799 10.1063/1.1488920 1:CAS:528:DC%2BD38Xls1Slsrs%3D (Pubitemid 34945466)
-
(2002)
Journal of Chemical Physics
, vol.117
, Issue.6
, pp. 2790
-
-
Cole, G.C.1
Legon, A.C.2
Ottaviani, P.3
-
24
-
-
0032540788
-
-
10.1016/S0009-2614(98)00587-9 1:CAS:528:DyaK1cXltVaju7s%3D
-
SA Cooke GK Corlett AC Legon 1998 Chem Phys Lett 291 269 276 10.1016/S0009-2614(98)00587-9 1:CAS:528:DyaK1cXltVaju7s%3D
-
(1998)
Chem Phys Lett
, vol.291
, pp. 269-276
-
-
Cooke, S.A.1
Corlett, G.K.2
Legon, A.C.3
-
27
-
-
0000061465
-
-
10.1016/S0009-2614(98)01200-7 1:CAS:528:DyaK1cXns1Kkt78%3D
-
SA Cooke JH Holloway AC Legon 1998 Chem Phys Lett 298 151 160 10.1016/S0009-2614(98)01200-7 1:CAS:528:DyaK1cXns1Kkt78%3D
-
(1998)
Chem Phys Lett
, vol.298
, pp. 151-160
-
-
Cooke, S.A.1
Holloway, J.H.2
Legon, A.C.3
-
30
-
-
0038626673
-
-
Revision D.01. Gaussian Inc, Wallingford, CT
-
Frisch MJ, Trucks GW et al. (2004) Gaussian 03, Revision D.01. Gaussian Inc, Wallingford, CT
-
(2004)
Gaussian 03
-
-
Frisch, M.J.1
Trucks, G.W.2
-
31
-
-
84890021933
-
-
10.1080/00268977000101561 1:CAS:528:DC%2BD2sXht1alt7fM
-
SF Boys F Bernardi 1970 Mol Phys 19 553 566 10.1080/00268977000101561 1:CAS:528:DC%2BD2sXht1alt7fM
-
(1970)
Mol Phys
, vol.19
, pp. 553-566
-
-
Boys, S.F.1
Bernardi, F.2
-
32
-
-
0011083499
-
-
10.1021/cr00088a005 1:CAS:528:DyaL1cXmtlOitbw%3D
-
AE Reed LA Curtiss F Weinhold 1988 Chem Rev 88 899 926 10.1021/cr00088a005 1:CAS:528:DyaL1cXmtlOitbw%3D
-
(1988)
Chem Rev
, vol.88
, pp. 899-926
-
-
Reed, A.E.1
Curtiss, L.A.2
Weinhold, F.3
-
38
-
-
4243272445
-
-
Version 1.0. University of Applied Science, Bielefeld, Germany
-
Biegler-König F (2000) AIM 2000, Version 1.0. University of Applied Science, Bielefeld, Germany
-
(2000)
AIM 2000
-
-
Biegler-König, F.1
-
42
-
-
1642580684
-
-
Feng Y, Liu L, Wang JT, Li XS, Guo QX (2004) Chem Commun 88-89
-
(2004)
Chem Commun
, pp. 88-89
-
-
Feng, Y.1
Liu, L.2
Wang, J.T.3
Li, X.S.4
Guo, Q.X.5
-
45
-
-
55149113111
-
-
10.1007/s11434-008-0450-y 1:CAS:528:DC%2BD1cXhtlWltLnK
-
K Yuan YC Zhu YZ Liu ZF Li XN Dong XF Wang HX Li J Zhang 2008 Chin Sci Bull 53 3151 3158 10.1007/s11434-008-0450-y 1:CAS:528:DC%2BD1cXhtlWltLnK
-
(2008)
Chin Sci Bull
, vol.53
, pp. 3151-3158
-
-
Yuan, K.1
Zhu, Y.C.2
Liu, Y.Z.3
Li, Z.F.4
Dong, X.N.5
Wang, X.F.6
Li, H.X.7
Zhang, J.8
-
46
-
-
77954713977
-
-
10.1021/jp102748b 1:CAS:528:DC%2BC3cXnsFGgsbg%3D
-
RFW Bader 2010 J Phys Chem A 114 7431 7444 10.1021/jp102748b 1:CAS:528:DC%2BC3cXnsFGgsbg%3D
-
(2010)
J Phys Chem A
, vol.114
, pp. 7431-7444
-
-
Bader, R.F.W.1
-
49
-
-
66249125018
-
-
10.1021/jp9010845 1:CAS:528:DC%2BD1MXktlSktbY%3D
-
AD Yau EFC Byrd BM Rice 2009 J Phys Chem A 113 6166 6171 10.1021/jp9010845 1:CAS:528:DC%2BD1MXktlSktbY%3D
-
(2009)
J Phys Chem A
, vol.113
, pp. 6166-6171
-
-
Yau, A.D.1
Byrd, E.F.C.2
Rice, B.M.3
-
51
-
-
34248634865
-
QTAIM study of the closed-shell interactions in peptide secondary structures: A cluster treatment of oligo- and polyalanines
-
DOI 10.1016/j.cplett.2007.04.044, PII S0009261407004800
-
MV Vener AN Egorova DP Fomin VG Tsirelson 2007 Chem Phys Lett 440 279 285 10.1016/j.cplett.2007.04.044 1:CAS:528:DC%2BD2sXlslOrtLs%3D (Pubitemid 46770667)
-
(2007)
Chemical Physics Letters
, vol.440
, Issue.4-6
, pp. 279-285
-
-
Vener, M.V.1
Egorova, A.N.2
Fomin, D.P.3
Tsirelson, V.G.4
-
53
-
-
0036172852
-
Spectroscopic and theoretical studies on the monomeric and dimeric forms of methyl pyrrole-2-carboxylate
-
DOI 10.1039/b107536p
-
AT Dubis SJ Grabowski 2002 New J Chem 26 165 169 10.1039/b107536p 1:CAS:528:DC%2BD38XntFCqsw%3D%3D (Pubitemid 34133052)
-
(2002)
New Journal of Chemistry
, vol.26
, Issue.1
, pp. 165-169
-
-
Dubis, A.T.1
Grabowski, S.J.2
-
54
-
-
34948860156
-
Topological characteristics of electron density distribution in SSXY → XSSY (X or y = F, Cl, Br, I) isomerization reactions
-
DOI 10.1021/jp073455k
-
YL Zeng LP Meng XY Li SJ Zheng 2007 J Phys Chem A 111 9093 9101 10.1021/jp073455k 1:CAS:528:DC%2BD2sXpsFyhsb4%3D (Pubitemid 47522562)
-
(2007)
Journal of Physical Chemistry A
, vol.111
, Issue.37
, pp. 9093-9101
-
-
Zeng, Y.1
Meng, L.2
Li, X.3
Zheng, S.4
-
56
-
-
4043071925
-
-
10.1021/ic0496121 1:CAS:528:DC%2BD2cXlvFGiu74%3D
-
YL Zeng SJ Zheng LP Meng 2004 Inorg Chem 43 5311 5320 10.1021/ic0496121 1:CAS:528:DC%2BD2cXlvFGiu74%3D
-
(2004)
Inorg Chem
, vol.43
, pp. 5311-5320
-
-
Zeng, Y.L.1
Zheng, S.J.2
Meng, L.P.3
-
57
-
-
0042352353
-
-
10.1002/(SICI)1096-987X(19970715)18:9<1167::AID-JCC5>3.0.CO;2-P 1:CAS:528:DyaK2sXksVKmsLo%3D
-
SJ Zheng LP Meng XH Cai ZF Xu XY Fu 1997 J Comput Chem 18 1167 1174 10.1002/(SICI)1096-987X(19970715)18:9<1167::AID-JCC5>3.0.CO;2-P 1:CAS:528:DyaK2sXksVKmsLo%3D
-
(1997)
J Comput Chem
, vol.18
, pp. 1167-1174
-
-
Zheng, S.J.1
Meng, L.P.2
Cai, X.H.3
Xu, Z.F.4
Fu, X.Y.5
-
58
-
-
0037027416
-
- (X=F, Cl and Br) complexes: Topological analysis of electron localization function
-
DOI 10.1002/qua.10227, Dedicated to Josef Stanislaw Kawiakowski
-
S Berski Z Latajka 2002 Int J Quantum Chem 90 1108 1120 10.1002/qua.10227 1:CAS:528:DC%2BD38XnslGns7g%3D (Pubitemid 35221223)
-
(2002)
International Journal of Quantum Chemistry
, vol.90
, Issue.3
, pp. 1108-1120
-
-
Berski, S.1
Latajka, Z.2
-
61
-
-
0001180452
-
-
10.1021/jp953512m 1:CAS:528:DyaK28XjsVSks7o%3D
-
RGA Bone RFW Bader 1996 J Phys Chem 100 10892 10911 10.1021/jp953512m 1:CAS:528:DyaK28XjsVSks7o%3D
-
(1996)
J Phys Chem
, vol.100
, pp. 10892-10911
-
-
Bone, R.G.A.1
Bader, R.F.W.2
-
62
-
-
0034669695
-
-
10.1021/ja0017864 1:CAS:528:DC%2BD3cXns1emt70%3D
-
I Rozas I Alkorta J Elguero 2000 J Am Chem Soc 122 11154 11161 10.1021/ja0017864 1:CAS:528:DC%2BD3cXns1emt70%3D
-
(2000)
J Am Chem Soc
, vol.122
, pp. 11154-11161
-
-
Rozas, I.1
Alkorta, I.2
Elguero, J.3
|