SCOPUS 정보 검색 플랫폼

Volumn 8, Issue 9, 2002, Pages 2047-2056

Through-space spin-spin coupling in van der waals dimers and CH/π interacting systems. An ab initio and DFT study

(3) Bagno, Alessandro a Saielli, Giacomo a Scorrano, Gianfranco a

Author keywords

Ab initio calculations; CH interactions density functional calculations; NMR spectroscopy; Spin spin coupling; Van der Waals interactions

Indexed keywords

CHEMICAL BONDS; ESTERS; MOLECULAR STRUCTURE;

SPIN-SPIN COUPLINGS;

DIMERS;

ACETONITRILE; BENZENE; DIMER; ESTER; ETHYLENE; IMINE; METHANE;

ARTICLE; CALCULATION; CHEMICAL BINDING; COVALENT BOND; DIPOLE; MOLECULAR INTERACTION; MOLECULAR STABILITY; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY;

EID: 0037012709 PISSN: 09476539 EISSN: None Source Type: Journal
DOI: 10.1002/1521-3765(20020503)8:9<2047::AID-CHEM2047>3.0.CO;2-Z Document Type: Article

Times cited : (55)

References (62)

1
- 0000894446
- (2000) Angew. Chem. , vol.112 , pp. 1276
- Gemmecker, G.¹

2
- 0034599393
- and references therein for a brief summary of this field up to 1999
- (2000) Angew. Chem. Int. Ed. , vol.39 , pp. 1224

3
- 0040518458
- (2000) J. Am. Chem. Soc. , vol.122 , pp. 9289
- Löhr, F.¹ Mayhew, S.G.² Rüterjans, H.³

4
- 0034607288
- (2000) J. Am. Chem. Soc. , vol.122 , pp. 3206
- Liu, A.¹ Majumdar, A.² Hu, W.³ Kettani, A.⁴ Skripkin, E.⁵ Patel, D.J.⁶

5
- 0034697648
- (2000) J. Am. Chem. Soc. , vol.122 , pp. 5883
- Mishima, M.¹ Hatanaka, M.² Yokoyama, S.³ Ikegami, T.⁴ Wälchli, M.⁵ Ito, Y.⁶ Shirakawa, M.⁷

6
- 0034245988
- (2000) J. Phys. Chem. A , vol.104 , pp. 7165
- Del Bene, J.E.¹ Perera, S.A.² Bartlett, R.J.³ Alkorta, I.⁴ Elguero, J.⁵

7
- 33645102812
- (1998) Ber. Bunsen-Ges. Phys. Chem. , vol.102 , pp. 422
- Shenderovich, I.G.¹ Smirnov, S.N.² Denisov, G.S.³ Gindin, V.A.⁴ Golubev, N.S.⁵ Dunger, A.⁶ Reibke, R.⁷ Kirpekar, S.⁸ Malkina, O.L.⁹ Limbach, H.H.¹⁰

8
- 0000827295
- (1999) Chem. Phys. Lett. , vol.308 , pp. 486
- Pecul, M.¹ Sadlej, J.²

9
- 0033618071
- (1999) J. Am. Chem. Soc. , vol.121 , pp. 6019
- Dingley, A.J.¹ Masse, J.E.² Peterson, R.D.³ Barfield, M.⁴ Feigon, J.⁵ Grzesiek, S.⁶

10
- 0034794182
- (2001) J. Am. Chem. Soc. , vol.123 , pp. 4014
- Barfield, M.¹ Dingley, A.J.² Feigon, J.³ Grzesiek, S.⁴

11
- 0345540637
- (1999) J. Am. Chem. Soc. , vol.121 , pp. 8661
- Scheurer, C.¹ Brüschweiler, R.²

12
- 0000804136
- (1999) J. Phys. Chem. A , vol.103 , pp. 8121
- Del Bene, J.E.¹ Perera, S.A.² Bartlett, R.J.³

13
- 2142813421
- (1999) J. Am. Chem. Soc. , vol.121 , pp. 3560
- Del Bene, J.E.¹ Perera, S.A.² Bartlett, R.J.³

14
- 0034679017
- (2000) J. Am. Chem. Soc. , vol.122 , pp. 4794
- Del Bene, J.E.¹ Jordan, M.J.T.²

15
- 0034249011
- (2000) J. Phys. Chem. A , vol.104 , pp. 8105
- Pecul, M.¹ Leszczynski, J.² Sadlej, J.³

16
- 0000542646
- (2000) J. Chem. Phys. , vol.112 , pp. 7930
- Pecul, M.¹ Leszczynski, J.² Sadlej, J.³

17
- 0034683089
- (2000) Chem. Eur. J. , vol.6 , pp. 2925
- Bagno, A.¹

18
- 0001477338
- (1999) J. Phys. Chem. A , vol.103 , pp. 7083
- Dannenberg, J.J.¹ Haskamp, L.² Matsunov, A.³

19
- 0035902324
- (2001) J. Phys. Chem. A , vol.105 , pp. 4737
- Matsunov, A.¹ Dannenberg, J.J.² Contreras, R.H.³

20
- 0034722991
- (2000) J. Am. Chem. Soc. , vol.122 , pp. 12835
- Arnold, W.D.¹ Oldfield, E.²

21
- 0033625572
- (2000) Spectrochim. Acta , vol.56 A , pp. 1167
- Jaime-Figueroa, S.¹ Kurz, L.J.² Liu, Y.³ Cruz, R.⁴

22
- 0001613999
- (1977) J. Org. Chem. , vol.42 , pp. 2411
- Adcock, W.¹ Bullpitt, M.² Kitching, W.³

23
- 84989095892
- (1991) Magn. Reson. Chem. , vol.29 , pp. 422
- Gribble, G.W.¹ Keavy, D.J.² Olson, E.R.³ Rae, I.D.⁴ Staffa, A.⁵ Her, T.H.⁶ Ferraro, M.B.⁷ Contreras, R.H.⁸

24
- 0034600286
- (2000) J. Am. Chem. Soc. , vol.122 , pp. 4108
- Mallory, F.B.¹ Mallory, C.W.² Butler, K.E.³ Lewis, M.B.⁴ Xia, A.Q.⁵ Luzik E.D., Jr.⁶ Fredenburgh, L.E.⁷ Ramanjulu, M.M.⁸ Van, Q.N.⁹ Francl, M.M.¹⁰ Freed, D.A.¹¹ Wray, C.C.¹² Hann, C.¹³ Nerz-Stormes, M.¹⁴ Carroll, P.J.¹⁵ Chirlian, L.E.¹⁶

25
- 0034645615
- (2000) J. Am. Chem. Soc. , vol.122 , pp. 12164
- Arnold, W.D.¹ Mao, J.² Sun, H.³ Oldfield, E.⁴

26
- 0001270774
- (1998) Mol. Phys. , vol.94 , pp. 307
- Salsbury, F.R.¹ Harris, R.A.²

27
- 0034514225
- (2000) J. Chem. Phys. , vol.113 , pp. 10835
- Pecul, M.¹

28
- 0035934508
- (2001) J. Chem. Phys. , vol.115 , pp. 5498
- Pecul, M.¹ Sadlej, J.² Leszczynski, J.³

29
- 0033553157
- (1999) J. Am. Chem. Soc. , vol.121 , pp. 3502
- Luhmer, M.¹ Goodson, B.M.² Song, Y.-Q.³ Laws, D.D.⁴ Kaiser, L.G.⁵ Cyrier, M.C.⁶ Pines, A.⁷

30
- 0035312294
- (2001) A. Collet. Chem. Eur. J. , vol.7 , pp. 1561
- Brotin, T.¹ Devic, T.² Lesage, A.³ Emsley, L.⁴

31
- 0003505803
- Wiley-VCH, New York
- (1998) The CH/π Interaction, Evidence, Nature and Consequences
- Nishio, M.¹ Hirota, M.² Umezawa, Y.³

32
- 0034683019
- (2000) Tetrahedron , vol.56 , pp. 6185
- Takahashi, H.¹ Tsuboyama, S.² Umezawa, Y.³ Honda, K.⁴ Nishio, M.⁵

33
- 0041936278
- (1991) J. Chem. Inf. Comput. Sci. , vol.31 , pp. 187
- Allen, F.H.¹ Davies, J.E.² Galloy, J.J.³ Johnson, O.⁴ Kennard, O.⁵ McRae, C.F.⁶ Mitchell, E.M.⁷ Mitchell, G.F.⁸ Smith, J.M.⁹ Watson, D.J.¹⁰

34
- 0034614644
- (2000) Chem. Commun. , pp. 21
- Howarth, O.W.¹ Nelson, J.² McKee, V.³

35
- 0001578031
- (2001) Angew. Chem. , vol.113 , pp. 2600
- Bagno, A.¹ Saielli, G.² Scorrano, G.³

36
- 2142703372
- (2001) Angew. Chem. Int. Ed. , vol.41 , pp. 2532

38
- 84890021933
- (1970) Mol. Phys. , vol.19 , pp. 553
- Boys, S.F.¹ Bernardi, F.²

39
- 0030580842
- (1996) Chem. Phys. Lett. , vol.252 , pp. 206
- Tsuzuki, S.¹ Uchimaru, T.² Mikami, M.³ Tanabe, K.⁴

40
- 0000306071
- (1991) J. Phys. Chem. , vol.95 , pp. 2272
- Tsuzuki, S.¹ Tanabe, K.²

41
- 33746614482
- (1987) J. Chem. Phys. , vol.98 , pp. 1007
- Dunning, T.H.¹

42
- 0032509032
- (1998) Theor. Chem. Acc. , vol.100 , pp. 275
- Enevoldsen, T.¹ Oddershede, J.² Sauer, S.P.A.³

43
- 0001248662
- (2000) J. Chem. Phys. , vol.112 , pp. 6201
- Provasi, P.F.¹ Aucar, G.A.² Sauer, S.P.A.³

44
- 0035878896
- (2001) J. Chem. Phys. , vol.115 , pp. 1324
- Provasi, P.F.¹ Aucar, G.A.² Sauer, S.P.A.³

46
- 0003442182
- (Eds.: J. Labanowski, J. Andzelm), Springer, New York
- (1991) Density Functional Methods in Chemistry
- Salahub, D.R.¹ Fournier, R.² Mlynarski, P.³ Papai, I.⁴ St-Amant, A.⁵ Ushio, J.⁶

47
- 0000244735
- (1990) Chem. Phys. Lett. , vol.169 , pp. 387
- St-Amant, A.¹ Salahub, D.R.²

48
- 0000814728
- (1994) J. Am. Chem. Soc. , vol.116 , pp. 5898
- Malkin, V.G.¹ Malkina, O.L.² Casida, M.³ Salahub, D.R.⁴

49
- 0003622715
- (Eds.: J.M. Seminario, P. Politzer), Elsevier, Amsterdam
- (1995) Modern Density Functional Theory: A Tool for Chemistry , vol.2
- Malkin, V.G.¹ Malkina, O.L.² Eriksson, L.A.³ Salahub, D.R.⁴

50
- 43949161745
- (1994) Chem. Phys. Lett. , vol.221 , pp. 91
- Malkin, V.G.¹ Malkina, O.L.² Salahub, D.R.³

51
- 0001010310
- (1996) J. Chem. Phys. , vol.105 , pp. 8793
- Malkina, O.L.¹ Salahub, D.R.² Malkin, V.G.³

52
- 0000216001
- (1980) Can. J. Phys. , vol.58 , pp. 1200
- Vosko, S.H.¹ Wilk, L.² Nusair, M.³

53
- 18144378706
- (1986) Phys. Rev. B , vol.33 , pp. 8800
- Perdew, J.P.¹ Wang, Y.²

54
- 5944261746
- (1986) Phys. Rev. B , vol.33 , pp. 8822
- Perdew, J.P.¹

55
- 0004165142
- Springer Berlin
- (1990) NMR-Basic Pinciples and Progress , vol.23
- Kutzelnigg, W.¹ Fleischer, U.² Schindler, M.³

56
- 0000584523
- (1999) Chem. Rev. , vol.99 , pp. 293
- Helgaker, T.¹ Jaszunski, M.² Ruud, K.³

57
- 0035901626
- (2001) Chem. Eur. J. , vol.7 , pp. 1652
- Bagno, A.¹

58
- 0003998388
- CRC Press, Boca Raton
- (1988) Handbook of Chemistry and Physics, 69th ed.

59
- 0038774655
- (1996) J. Chem. Phys. , vol.105 , pp. 2780
- Jaffe, R.L.¹ Smith, G.D.²

60
- 21844509764
- (1994) J. Incl. Phenom. , vol.19 , pp. 277
- Xu, W.¹ Puddephatt, R.J.² Manojlovic-Muir, L.³ Muir, K.W.⁴ Frampton, C.S.⁵

61
- 0002715123
- (1990) J. Chem. Soc. Perkin Trans. 2 , pp. 25
- Hamor, T.A.¹ Jennings, W.B.² Proctor, L.D.³ Tolley, M.S.⁴ Boyd, D.R.⁵ Mullan, T.⁶

62
- 12044259820
- (1994) J. Am. Chem. Soc. , vol.116 , pp. 4497
- Paliwal, S.¹ Geib, S.² Wilcox, C.S.³

* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.