Exceptional coordination mode of unsaturated PNP ligands (Me 3Si)2C=PN(R)PPh2 with palladium and platinum dichlorides: insertion of phosphaalkene phosphorus atoms into metal-chlorine bonds

European Journal of Inorganic Chemistry

Volumn , Issue 20, 2009, Pages 2901-2905

  Lungu, Daniela ^a   Daniliuc, Constantin ^a   Jones, Peter G ^a   Nyulászi, László ^b   Benkõ, Zoltán ^b   Bartsch, Rainer ^a   Mont, Wolf W Du ^a  

^a TECHNICAL UNIVERSITY OF BRAUNSCHWEIG   (Germany)

^b BUDAPEST UNIVERSITY OF TECHNOLOGY AND ECONOMICS   (Hungary)

Author keywords

Density functional calculations; Insertion; P chloroylides; Palladium; Phosphaalkenes; Platinum

Indexed keywords

ATOMS; CHELATION; CHLORINE; DENSITY FUNCTIONAL THEORY; LIGANDS; PALLADIUM COMPOUNDS; PHOSPHORUS; PLATINUM COMPOUNDS;

BIS-CHELATE COMPLEXES; CHLORIDE IONS; COORDINATION MODES; CRYSTALLINE SOLIDS; DENSITY-FUNCTIONAL CALCULATIONS; INSERTION; P-CHLOROYLIDE; PALLADIUM AND PLATINUM; PHOSPHAALKENES; PHOSPHORUS ATOM;

CHLORINE COMPOUNDS;

EID: 67650422066     PISSN: 14341948     EISSN: 10990682     Source Type: Journal    
DOI: 10.1002/ejic.200900236     Document Type: Article

References (52)

1. a) J. T. Dixon, M. J. Green, F. M. Hess, D. H. Morgan, J. Organomet. Chem. 2004, 689, 3641-3668;
2. b) M. J. Overett, K. Blann, A. Bollmann, J. T. Dixon, F. M. Hess, E. Kilian, H. Maumela, D. H. Morgan, A. Neveling, Chem. Commun. 2005, 622-624;
3. c) D. F. Wass, Dalton Trans. 2007, 816-819.
4. a) S. Ikeda, F. Ohata, M. Miyoshi, R. Tanaka, T. Minami, F. Ozawa, M. Yoshifuji, Angew. Chem. 2000,112, 4686-4687;
5. Angew. Chem. Int. Ed. 2000, 39, 4512-4513;
6. b) T. Minami, H. Okamoto, S. Ikeda, R. Tanaka, F. Ozawa, M. Yoshifuji, Angew. Chem. 2001, 113, 4633-4635;
7. Angew. Chem. Int. Ed. 2001, 40, 4501-4503;
8. c) F. Ozawa, S. Yamamoto, S. Kawagishi, M. Hiraoka, S. Ikeda, T. Minami, S. Ito, M. Yoshifuji, Chem. Lett. 2001, 972-973;
9. d) F. Ozawa, H. Okamoto, S. Kawagishi, S. Yamamoto, T. Minami, M. Yoshifuji, J. Am. Chem, Soc. 2002, 124, 10968-10969;
10. e) H. Murakami, T. Minami, F. Ozawa, J. Org. Chem. 2004, 69, 4482-4486.
11. a) A. S. Gajare, K. Toyota, M. Yoshifuji, F. Ozawa, Chem. Commun. 2004, 1994-1995;
12. b) A. S. Gajare, K. Toyota, M. Yoshifuji, F. Ozawa, J. Org. Chem. 2004, 69, 6504-6506.
13. A. Modelli, B. Hajgató, J'. F. Nixon, L. Nyulászi, J. Phys. Chem. A 2004, 108, 7440-7447.
14. a) J. F. Nixon, Chem. Rev. 1988, 88, 1327-1362;
15. b) P. Le Floch, Coord. Chem. Rev. 2006, 250, 627-681.
16. M. Regitz, O. J. Scherer (Eds.), Multiple Bonds and Low Coordination in Phosphorus Chemistry, Thieme, Stuttgart, 1990, ch. D4, pp. 157-219 and eh. D8, pp. 293-320.
17. D. Lungu, R. Bartsch, W.-W. du Mont, C. Daniliuc, unpublished results, 2008.
18. a) O. J. Scherer, G. Schieder, Angew. Chem. 1968, 80, 83-84
19. Angew. Chem. Int. Ed, Engl. 1968, 7, 75-76;
20. b) O. J. Scherer, W.M. Janssen, J. Organomet. Chem. 1969, 20, 111-116;
21. c) M. T Ashby, Z. Li, Inorg. Chem. 1992, 31, 1321-1322;
22. d) G. Trinquier, M. T Ashby, Inorg. Chem. 1994, 33, 1306-1310;
23. e) N Poetschke, M. Nieger, M. A. Khan, E. Niecke, M. T Ashby, Inorg. Chem. 1997, 36, 4087-4093;
24. f) Z. Fei, R. Scopelliti, P. J. Dyson, Inorg. Chem. 2003, 42, 2125-2130;
25. g) Z. Fei, N Biricik, D. Zhao, R. Scopelliti, R.J. Dyson, Inorg. Chem. 2004, 43, 2228-2230.
26. R. J. Cross, T H. Green, R. Keat, J. Chem. Soe, Dalton Trans. 1976, 1424-1428.
27. a) 14th Int. Conf. on Phosphorus Chemistry, Cincinnati, 1998, Abstract: V. Thelen, M. Nieger, E. Niecke, Phosphorus Sulfur Silicon Relat. Elem. 1999, 147, 407;
28. b) E. Niecke, V. Zota," C. Volkholz, unpublished results.
29. a) R. M. Birzoi, D. Bugnariu, R. Guerrero Gimeno, D. Lungu, V. Zota, C. Hrib, C. Daniliuc, P. G. Jones, Z. Benkõ, L. Nyulászi, R. Bartsch, W.-W. du Mont, E. Niecke, manuscript to be submitted (2009);
30. b) R. Guerrero Gimeno, Dissertation, Techn. Univ. Braunschweig, Germany, 2008.
31. A. N. Chernega, E. B. Rusanov, A. V. Ruban, V. D. Romanenko, Zh. Obshch. Khim. 1991, 61, 117.
32. O. I. Kolodiazhnyi, Phosphorus Ylides, Wiley-VCH, Weinheim, 1999, ch. 5.3, pp. 306-343.
33. a) H. J. Grützmacher, H. Pritzkow, Angew. Chem. 1991, 103,
34. 721-723; Angew. Chem. Int. Ed. Engl. 1991, 30, 709-710;
35. b) H. J. Grützmacher, H. Pritzkow, Angew. Chem. 1992, 104, 92-94;
36. Angew. Chem. Int. Ed. Engl. 1992, 31, 99-101;
37. c) U Heim, H. Pritzkow, H. Schönberg, H. J. Grützmacher, J. Chem. Soc., Chem. Commun. 1993, 673-674.
38. a) The geometries were optimised with the B3LYP functional by using LanL2DZ(dp)ECP-basis on Pt and 6-31+G* basis on the other elements (henceforth abbreviated as basis set A) with the program package Gaussian 03, Revision C.02: M. J. Frisch, G. W Trucks, H. B. Schlegel, G. E. Scuseria, M. A. Robb, J. R. Cheeseman, J. A. Montgomery Jr, T Vreven, K. N Kudin, J. C. Burant, J. M. Millam, S. S. Iyengar, J. Tomasi, V. Barone, B. Mennucci, M. Cossi, G. Scalmani, N. Rega, G. A. Petersson, H. Nakatsuji, M. Hada, M. Ehara, K. Toyota, R. Fukuda, J. Hasegawa, M. Ishida, T. Nakajima, Y. Honda, O. Kitao, H. Nakai, M. Klene, X. Li, J. E. Knox, H. P. Hratchian, J. B. Cross, V. Bakken, C. Adamo, J Jaramillo, R. Gomperts, R. E. Stratmann, O. Yazyev, A. J. Austin, R. Cammi, C. Pomelli, J. W Ochterski, P. Y. Ayala, K. Morokuma, G. A. Voth, P. Salvador, J. J. Dannenberg, V. G. Zakrzewski, S. Dapprich, A. D. Daniels, M. C. Strain, O. Farkas, D. K. Malick, A. D. Rabuck, K. Raghavachari, J. B. Foresman, J. V. Ortiz, Q. Cui, A. G. Baboul, S. Clifford, J. Cioslowski, B. B. Stefanov, G. Liu, A. Liashenko, P. Piskorz, I. Komaromi, R. L. Martin, D. J. Fox, T. Keith, M. A. Al-Laham, C. Y. Peng, A. Nanayakkara, M. Challacombe, P. M. W. Gill, B. Johnson, W Chen, M. W Wong, C. Gonzalez, J. A. Pople, Gaussian 03, Revision C.02, Gaussian Inc., Wallingford CT, 2004. For the optimised geometries analytical second derivatives were calculated to check the nature of the stationary point, and single-point calculations were performed by using DZVP basis and the MDF pseudopotentials on Pt, and the 6-31+G* basis set on all the other elements (abbreviated as basis set B);
39. b) For Pt, the above-mentioned DZPP basis set-ECP combination was used.
40. R. G. Parr, L. v. Szentpály, S. Liu, J. Am. Chem. Soc. 1999, 121, 1922-1924.
41. For these molecules, the electrophilicity indices calculated at the (U)B3LYP/6-311+G** level are in excellent agreement with the (U)CCSD(T)/aug-cc-pVTZ results (1.037 eV, 1.655 eV and 1.638 eV, respectively).
42. R. G. Parr, W Yang, J. Am. Chem. Soc. 1984, 106, 4049-4050.
43. [19]a) Y Li, J.N. S. Evans, J. Am. Chem. Soc. 1995, 117, 7756-7759;
44. b) R. R. Contreras, P. Fuentealba, M. Galván, P. Pérez, Chem. Phys. Lett. 1999, 304, 405-413.
45. A. Jouati, M. Geoffroy, G. Bemardinelli, Chem. Commun. 1996, 437-438.
46. a) D. Carmichael, P. Le Floch, F. Mathey, Phosphorus Sulfur ' Silicon Relat. Elem. 1993, 77, 255;
47. b) R Le Floch, S. Mansuy, P. Rosa, L. Ricard, F. Mathey, A. Jutand, C. Amatore, Organometallics 1996, 15, 3267-3274.
48. a) D. Gudat, M. Schrott, M. Nieger, J. Chem. Soc., Chem. Commun. 1995, 1541-1542;
49. b) D. Gudat, M. Schrott, M. Ni-eger, Chem. Ber. 1995, 128, 259-266;
50. c) D. Gudat, M. Nieger, M. Schrott, Inorg. Chem. 1997, 36, 1476-1481.
51. a) H. Liang, K. Nishide, S. Ito, M. Yoshifuji, Tetrahedron Lett. 2003, 44, 8297-8300;
52. b) S. Ito, K. Nishide, S. Ito, M. Yoshifuji,J. Organomet. Chem. 2005, 690, 2531-2535.