-
1
-
-
0032525587
-
-
and references therein
-
Portalone, G.; Ramondo, F.; Domenicano, A.; Hargittai, I. J. Organomet. Chem. 1998, 560, 183 and references therein.
-
(1998)
J. Organomet. Chem.
, vol.560
, pp. 183
-
-
Portalone, G.1
Ramondo, F.2
Domenicano, A.3
Hargittai, I.4
-
2
-
-
0041877480
-
-
Campanelli, A. R.; Domenicano, A.; Ramondo, F. J. Phys. Chem. A 2003, 107, 6429.
-
(2003)
J. Phys. Chem. A
, vol.107
, pp. 6429
-
-
Campanelli, A.R.1
Domenicano, A.2
Ramondo, F.3
-
3
-
-
84977307525
-
-
See also: Domenicano, A.; Murray-Rust, P.; Vaciago, A. Acta Crystaltogr., Sect. B 1983, 39, 457.
-
(1983)
Acta Crystaltogr., Sect. B
, vol.39
, pp. 457
-
-
Domenicano, A.1
Murray-Rust, P.2
Vaciago, A.3
-
5
-
-
49949125829
-
-
Nygaard, L.; Bojesen, I.; Pedersen, T.; Rastrup-Andersen, J. J. Mol. Struct. 1968, 2, 209.
-
(1968)
J. Mol. Struct.
, vol.2
, pp. 209
-
-
Nygaard, L.1
Bojesen, I.2
Pedersen, T.3
Rastrup-Andersen, J.4
-
6
-
-
0001482896
-
-
Domenicano, A.; Vaciago, A.; Coulson, C. A. Acta Crystallogr., Sect. B 1975, 31, 221.
-
(1975)
Acta Crystallogr., Sect. B
, vol.31
, pp. 221
-
-
Domenicano, A.1
Vaciago, A.2
Coulson, C.A.3
-
7
-
-
2942724416
-
-
Campanelli, A. R.; Domenicano, A.; Ramondo, F.; Hargittai, I. J. Phys. Chem. A 2004, 108, 4940.
-
(2004)
J. Phys. Chem. A
, vol.108
, pp. 4940
-
-
Campanelli, A.R.1
Domenicano, A.2
Ramondo, F.3
Hargittai, I.4
-
9
-
-
0010803682
-
-
(b) Norrestam, R.; Schepper, L. Acta Chem. Scand., Part A 1981, 35, 91.
-
(1981)
Acta Chem. Scand., Part A
, vol.35
, pp. 91
-
-
Norrestam, R.1
Schepper, L.2
-
10
-
-
0007844918
-
-
George, P.; Bock, C. W.; Trachtman, M. J. Mol. Struct. (THEOCHEM) 1986, 137, 387.
-
(1986)
J. Mol. Struct. (THEOCHEM)
, vol.137
, pp. 387
-
-
George, P.1
Bock, C.W.2
Trachtman, M.3
-
11
-
-
0001220365
-
-
Bock, C. W.; Domenicano, A.; George, P.; Hargittai, I.; Portalone, G.; Schultz, G. J. Phys. Chem. 1987, 91, 6120.
-
(1987)
J. Phys. Chem.
, vol.91
, pp. 6120
-
-
Bock, C.W.1
Domenicano, A.2
George, P.3
Hargittai, I.4
Portalone, G.5
Schultz, G.6
-
12
-
-
0011045381
-
-
Hargittai, I., Hargittai, M., Eds.; VCH Publishers: New York, Part B, Chapter 7
-
(e) Domenicano, A. In Stereochemical Applications of Gas-Phase Electron Diffraction; Hargittai, I., Hargittai, M., Eds.; VCH Publishers: New York, 1988; Part B, Chapter 7, pp 281-324.
-
(1988)
Stereochemical Applications of Gas-Phase Electron Diffraction
, pp. 281-324
-
-
Domenicano, A.1
-
13
-
-
0000159070
-
-
(f) Domenicano, A.; Schultz, G.; Hargittai, I.; Colapietro, M.; Portalone, G.; George, P.; Bock, C. W. Struct. Chem. 1989, 1, 107.
-
(1989)
Struct. Chem.
, vol.1
, pp. 107
-
-
Domenicano, A.1
Schultz, G.2
Hargittai, I.3
Colapietro, M.4
Portalone, G.5
George, P.6
Bock, C.W.7
-
14
-
-
0001935108
-
-
Domenicano, A., Hargittai, I., Eds.; Oxford University Press: Oxford, U.K., Chapter 18
-
(g) Domenicano, A. In Accurate Molecular Structures: Their Determination and Importance; Domenicano, A., Hargittai, I., Eds.; Oxford University Press: Oxford, U.K., 1992; Chapter 18, pp 437-468.
-
(1992)
Accurate Molecular Structures: Their Determination and Importance
, pp. 437-468
-
-
Domenicano, A.1
-
16
-
-
0000818787
-
-
See, e.g.: (a) Colapietro, M.; Domenicano, A.; Marciante, C.; Portalone, G. Z. Naturforsch., Teil B 1982, 37, 1309.
-
(1982)
Z. Naturforsch., Teil B
, vol.37
, pp. 1309
-
-
Colapietro, M.1
Domenicano, A.2
Marciante, C.3
Portalone, G.4
-
17
-
-
0001635488
-
-
(b) Colapietro, M.; Domenicano, A.; Portalone, G.; Schultz, G.; Hargittai, I. J. Phys. Chem. 1987, 91, 1728.
-
(1987)
J. Phys. Chem.
, vol.91
, pp. 1728
-
-
Colapietro, M.1
Domenicano, A.2
Portalone, G.3
Schultz, G.4
Hargittai, I.5
-
18
-
-
0000180110
-
-
Schultz, G.; Nagy, T.; Portalone, G.; Ramondo, F.; Hargittai, I.; Domenicano, A. Struct. Chem. 1993, 4, 183.
-
(1993)
Struct. Chem.
, vol.4
, pp. 183
-
-
Schultz, G.1
Nagy, T.2
Portalone, G.3
Ramondo, F.4
Hargittai, I.5
Domenicano, A.6
-
19
-
-
2342572629
-
-
Domenicano, A.; Arcadi, A.; Ramondo, F.; Campanelli, A. R.; Portalone, G.; Schultz, G.; Hargittai, I. J. Phys. Chem. 1996, 100, 14625.
-
(1996)
J. Phys. Chem.
, vol.100
, pp. 14625
-
-
Domenicano, A.1
Arcadi, A.2
Ramondo, F.3
Campanelli, A.R.4
Portalone, G.5
Schultz, G.6
Hargittai, I.7
-
20
-
-
0010560569
-
-
Cox, A. P.; Ewart, I. C.; Stigliani, W. M. J. Chem. Soc., Faraday Trans. 2 1975, 71, 504.
-
(1975)
J. Chem. Soc., Faraday Trans. 2
, vol.71
, pp. 504
-
-
Cox, A.P.1
Ewart, I.C.2
Stigliani, W.M.3
-
21
-
-
0001483667
-
-
Császár, A. G.; Fogarasi, G.; Boggs, J. E. J. Phys. Chem. 1989, 93, 7644.
-
(1989)
J. Phys. Chem.
, vol.93
, pp. 7644
-
-
Császár, A.G.1
Fogarasi, G.2
Boggs, J.E.3
-
22
-
-
3042578990
-
-
Dreizler, H.; Rudolph, H. D.; Hartke, B. J. Mol. Struct. 2004, 698, 1.
-
(2004)
J. Mol. Struct.
, vol.698
, pp. 1
-
-
Dreizler, H.1
Rudolph, H.D.2
Hartke, B.3
-
24
-
-
0001854116
-
-
Stang, P. J., Diederich, F., Eds.; VCH: Weinheim
-
Young, J. K.; Moore, J. S. In Modern Acetylene Chemistry; Stang, P. J., Diederich, F., Eds.; VCH: Weinheim, 1995; pp 415-442.
-
(1995)
Modern Acetylene Chemistry
, pp. 415-442
-
-
Young, J.K.1
Moore, J.S.2
-
26
-
-
0001881382
-
-
Haley, M. M.; Pak, J. J.; Brand, S. C. Top. Curr. Chem. 1999, 201, 81.
-
(1999)
Top. Curr. Chem.
, vol.201
, pp. 81
-
-
Haley, M.M.1
Pak, J.J.2
Brand, S.C.3
-
29
-
-
0004133516
-
-
Gaussian, Inc.: Pittsburgh, PA
-
Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Scuseria, G. E.; Robb, M. A.; Cheeseman, J. R.; Zakrzewski, V. G.; Montgomery, J. A., Jr.; Stratmann, R. E.; Burant, J. C.; Dapprich, S.; Millam, J. M.; Daniels, A. D.; Kudin, K. N.; Strain, M. C.; Farkas, O.; Tomasi, J.; Barone, V.; Cossi, M.; Cammi, R.; Mennucci, B.; Pomelli, C.; Adamo, C.; Clifford, S.; Ochterski, J.; Petersson, G. A.; Ayala, P. Y.; Cui, Q.; Morokuma, K.; Malick, D. K.; Rabuck, A. D.; Raghavachari, K.; Foresman, J. B.; Cioslowski, J.; Ortiz, J. V.; Stefanov, B. B.; Liu, G.; Liashenko, A.; Piskorz, P.; Komaromi, I.; Gomperts, R.; Martin, R. L.; Fox, D. J.; Keith, T.; Al-Laham, M. A.; Peng, C. Y.; Nanayakkara, A.; Gonzalez, C.; Challacombe, M.; Gill, P. M. W.; Johnson, B. G.; Chen, W.; Wong, M. W.; Andres, J. L.; Head-Gordon, M.; Replogle, E. S.; Pople, J. A. Gaussian 98, revision A.6; Gaussian, Inc.: Pittsburgh, PA, 1998.
-
(1998)
Gaussian 98, Revision A.6
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
Scuseria, G.E.4
Robb, M.A.5
Cheeseman, J.R.6
Zakrzewski, V.G.7
Montgomery Jr., J.A.8
Stratmann, R.E.9
Burant, J.C.10
Dapprich, S.11
Millam, J.M.12
Daniels, A.D.13
Kudin, K.N.14
Strain, M.C.15
Farkas, O.16
Tomasi, J.17
Barone, V.18
Cossi, M.19
Cammi, R.20
Mennucci, B.21
Pomelli, C.22
Adamo, C.23
Clifford, S.24
Ochterski, J.25
Petersson, G.A.26
Ayala, P.Y.27
Cui, Q.28
Morokuma, K.29
Malick, D.K.30
Rabuck, A.D.31
Raghavachari, K.32
Foresman, J.B.33
Cioslowski, J.34
Ortiz, J.V.35
Stefanov, B.B.36
Liu, G.37
Liashenko, A.38
Piskorz, P.39
Komaromi, I.40
Gomperts, R.41
Martin, R.L.42
Fox, D.J.43
Keith, T.44
Al-Laham, M.A.45
Peng, C.Y.46
Nanayakkara, A.47
Gonzalez, C.48
Challacombe, M.49
Gill, P.M.W.50
Johnson, B.G.51
Chen, W.52
Wong, M.W.53
Andres, J.L.54
Head-Gordon, M.55
Replogle, E.S.56
Pople, J.A.57
more..
-
32
-
-
0000834002
-
-
and references therein. We used the 1992 version of the program
-
Tai, J. C.; Yang, L.; Allinger, N. L. J. Am. Chem. Soc. 1993, 115, 11906 and references therein. We used the 1992 version of the program.
-
(1993)
J. Am. Chem. Soc.
, vol.115
, pp. 11906
-
-
Tai, J.C.1
Yang, L.2
Allinger, N.L.3
-
33
-
-
0042406343
-
-
Weber, E.; Hecker, M.; Koepp, E.; Orlia, W.; Czugler, M.; Csöregh, I. J. Chem. Soc., Perkin Trans. 2 1988, 1251.
-
(1988)
J. Chem. Soc., Perkin Trans. 2
, pp. 1251
-
-
Weber, E.1
Hecker, M.2
Koepp, E.3
Orlia, W.4
Czugler, M.5
Csöregh, I.6
-
36
-
-
0017504470
-
-
Tremmel, J.; Kolonits, M.; Hargittai, I. J. Phys. E 1977, 10, 664.
-
(1977)
J. Phys. e
, vol.10
, pp. 664
-
-
Tremmel, J.1
Kolonits, M.2
Hargittai, I.3
-
37
-
-
0002808381
-
-
Hargittai, I.; Tremmel, J.; Kolonits, M. Hung. Sci. Instrum. 1980, 50, 31.
-
(1980)
Hung. Sci. Instrum.
, vol.50
, pp. 31
-
-
Hargittai, I.1
Tremmel, J.2
Kolonits, M.3
-
38
-
-
0000077357
-
-
Hargittai, I.; Hernádi, J.; Kolonits, M.; Schultz, G. Rev. Sci. Instrum. 1971, 42, 546.
-
(1971)
Rev. Sci. Instrum.
, vol.42
, pp. 546
-
-
Hargittai, I.1
Hernádi, J.2
Kolonits, M.3
Schultz, G.4
-
39
-
-
0000373731
-
-
Domenicano, A.; Schultz, G.; Kolonits, M.; Hargittai, I. J. Mol. Struct. 1979, 53, 197.
-
(1979)
J. Mol. Struct.
, vol.53
, pp. 197
-
-
Domenicano, A.1
Schultz, G.2
Kolonits, M.3
Hargittai, I.4
-
40
-
-
0001463593
-
-
Andersen, B.; Seip, H. M.; Strand, T. G.; Stølevik, R. Acta Chem. Scand. 1969, 23, 3224.
-
(1969)
Acta Chem. Scand.
, vol.23
, pp. 3224
-
-
Andersen, B.1
Seip, H.M.2
Strand, T.G.3
Stølevik, R.4
-
41
-
-
0000703992
-
-
Tavard, C.; Nicolas, D.; Rouault, M. J. Chim. Phys. Phys. Chim. Biol. 1967, 64, 540.
-
(1967)
J. Chim. Phys. Phys. Chim. Biol.
, vol.64
, pp. 540
-
-
Tavard, C.1
Nicolas, D.2
Rouault, M.3
-
43
-
-
0035928161
-
-
Campanelli, A. R.; Ramondo, F.; Domenicano, A.; Hargittai, I. J. Phys. Chem. A 2001, 105, 5933.
-
(2001)
J. Phys. Chem. A
, vol.105
, pp. 5933
-
-
Campanelli, A.R.1
Ramondo, F.2
Domenicano, A.3
Hargittai, I.4
-
44
-
-
33644784386
-
-
note
-
Using bond-distance (and bond-angle) differences as independent parameters is customary in gas-phase electron diffraction work, as it facilitates the introduction of geometrical constraints in the least-squares refinement.
-
-
-
-
45
-
-
33644776313
-
-
Schultz, G.; Kolonits, M.; Domenicano, A.; Hargittai, I. Unpublished results
-
Schultz, G.; Kolonits, M.; Domenicano, A.; Hargittai, I. Unpublished results.
-
-
-
-
46
-
-
36849113843
-
-
Here and throughout this paper total errors are given as error limits; they have been calculated according to Hargittai, M.; Hargittai, I. J. Chem. Phys. 1973, 59, 2513. Least-squares standard deviations are in parentheses in units of the last digit.
-
(1973)
J. Chem. Phys.
, vol.59
, pp. 2513
-
-
Hargittai, M.1
Hargittai, I.2
-
47
-
-
0021595372
-
-
Bacon, A. R.; Hollas, J. M.; Ridley, T. Can. J. Phys. 1984, 62, 1254.
-
(1984)
Can. J. Phys.
, vol.62
, pp. 1254
-
-
Bacon, A.R.1
Hollas, J.M.2
Ridley, T.3
-
49
-
-
0039112787
-
-
Singh, K. M.; Singh, R. A.; Thakur, S. N. Spectrochim. Acta 1995, 51A, 269.
-
(1995)
Spectrochim. Acta
, vol.51 A
, pp. 269
-
-
Singh, K.M.1
Singh, R.A.2
Thakur, S.N.3
-
50
-
-
33644748842
-
-
note
-
One of the Reviewers suggested to compare our average structures from gas-phase electron diffraction with those from ab initio molecular dynamics calculations. We plan to carry out such calculations soon.
-
-
-
-
51
-
-
0742325413
-
-
Weiss, H.-C.; Bläser, D.; Boese, R.; Doughan, B. M.; Haley, M. M. Chem. Commun. 1997, 1703.
-
(1997)
Chem. Commun.
, pp. 1703
-
-
Weiss, H.-C.1
Bläser, D.2
Boese, R.3
Doughan, B.M.4
Haley, M.M.5
-
52
-
-
33644771804
-
-
note
-
Calculated from the atomic coordinates and unit-cell parameters in the Cambridge Structural Database. We have estimated the least-squares standard deviations from the R factor and the number of observations per refined parameter.
-
-
-
-
53
-
-
0033590709
-
-
Robinson, J. M. A.; Philp, D.; Kariuki, B. M.; Harris, K. D. M. Chem. Commun. 1999, 329.
-
(1999)
Chem. Commun.
, pp. 329
-
-
Robinson, J.M.A.1
Philp, D.2
Kariuki, B.M.3
Harris, K.D.M.4
-
54
-
-
0000975376
-
-
Robinson, J. M. A.; Kariuki, B. M.; Gough, R. J.; Harris, K. D. M.; Philp, D. J. Solid State Chem. 1997, 134, 203.
-
(1997)
J. Solid State Chem.
, vol.134
, pp. 203
-
-
Robinson, J.M.A.1
Kariuki, B.M.2
Gough, R.J.3
Harris, K.D.M.4
Philp, D.5
-
55
-
-
33644761500
-
-
note
-
Calculated from the atomic coordinates and unit-cell parameters given in the original paper.
-
-
-
|