Correction: Probing the nature of gold-carbon bonding in gold-alkynyl complexes (Nature Communications (2013) 4 (2223) DOI: 10.1038/ncomms3223);Probing the nature of gold-carbon bonding in gold-alkynyl complexes

Nature Communications

Volumn 4, Issue , 2013, Pages

  Liu, Hong Tao ^a   Xiong, Xiao Gen ^b   Diem Dau, Phuong ^a   Wang, Yi Lei ^b   Huang, Dao Ling ^a   Li, Jun ^b   Wang, Lai Sheng ^a  

^a BROWN UNIVERSITY   (United States)

^b TSINGHUA UNIVERSITY   (China)

Author keywords

[No Author keywords available]

Indexed keywords

ALKYNYL GROUP; CARBON; GOLD COMPLEX;

CARBON; CATALYSIS; GOLD; LIGAND; SPECTROSCOPY;

ARTICLE; CATALYST; CHEMICAL BINDING; DENSITY FUNCTIONAL THEORY; ELECTROSPRAY; NATURAL SCIENCE; X RAY PHOTOELECTRON SPECTROSCOPY;

EID: 84881452518     PISSN: None     EISSN: 20411723     Source Type: Journal    
DOI: 10.1038/ncomms16200     Document Type: Erratum

References (50)

1. Hashmi, A. S. K. Gold-catalyzed organic reactions. Chem. Rev. 107, 3180-3211 (2007). (Pubitemid 47177109)
2. Gorin, D. J., Sherry, B. D. & Toste, F. D. Ligand effects in homogeneous Au catalysis. Chem. Rev. 108, 3351-3378 (2008).
3. Jimenez-Nunez, E. & Echavarren, A. M. Gold-catalyzed cycloisomerizations of enynes: a mechanistic perspective. Chem. Rev. 108, 3326-3350 (2008).
4. Arcadi, A. Alternative synthetic methods through new developments in catalysis by gold. Chem. Rev. 108, 3266-3325 (2008).
5. Li, Z. G., Brouwer, C. & He, C. Gold-catalyzed organic transformations. Chem. Rev. 108, 3239-3265 (2008).
6. Schmidbaur, H. & Schier, A. Gold eta(2)-coordination to unsaturated and aromatic hydrocarbons: the key step in gold-catalyzed organic transformations. Organometallics 29, 2-23 (2010).
7. Corma, A., Leyva-Perez, A. & Sabater, M. J. Gold-catalyzed carbon-heteroatom bond-forming reactions. Chem. Rev. 111, 1657-1712 (2011).
8. Pyykkö, P. Relativisitic effects in structural chemistry. Chem. Rev. 88, 563-594 (1988).
9. Pyykkö, P. Theoretical chemistry of gold. Angew. Chem. Int. Ed. 43, 4412-4456 (2004). (Pubitemid 39257379)
10. Gorin, D. J. & Toste, F. D. Relativistic effects in homogeneous gold catalysis. Nature 446, 395-403 (2007). (Pubitemid 46476781)
11. Wang, L. S. Covalent gold. Phys. Chem. Chem. Phys. 12, 8694-8705 (2010).
12. Fedorov, A., Moret, M. E. & Chen, P. Gas-phase synthesis and reactivity of a gold carbene complex. J. Am. Chem. Soc. 130, 8880-8881 (2008). (Pubitemid 352000813)
13. Benitez, D. et al. A bonding model for gold(I) carbene complexes. Nat. Chem. 1, 482-486 (2009).
14. Wang, X. B. et al. Evidence of significant covalent bonding in Au(CN)2-. J. Am. Chem. Soc. 131, 16368-16370 (2009).
15. Liu, H. T. et al. The mixed cyanide halide Au(I) complexes, [XAuCN]-(X14 F, Cl, Br, and I): evolution from ionic to covalent bonding. Chem. Sci. 2, 2101-2108 (2011).
16. Mayer, I. Charge, bond order and valence in the ab initio SCF theory. Chem. Phys. Lett. 97, 270-274 (1983).
17. Manna, J., John, K. D. & Hopkins, M. D. The bonding of metal-alkynyl complexes. Adv. Organomet. Chem. 38, 79-154 (1995). (Pubitemid 126126950)
18. Palusiak, M., Guerra, C. F. & Bickelhaupt, F. M. p-electronic communication through mono and multinuclear gold(I) complexes. Int. J. Quant. Chem. 109, 2507-2519 (2009).
19. Sokolov, A. Y. & Sizova, O. V. Quantum-chemical study of trans influence on gold(I) linear complexes. Russ. J. Gener. Chem. 80, 1223-1231 (2010).
20. Schwerdtfeger, P., Boyd, P. D. W., Burrell, A. K., Robinson, W. T. & Taylor, M. J. Relativistic effects in gold chemistry. 3. Gold(I) complexes. Inorg. Chem. 29, 3593-3607 (1990).
21. Trinh, C., Timoshkin, A. Y. & Frenking, G. Thermodynamics of the decomposition processes of donor-acceptor complexes MX3-en-MX3 and MX3-en. Chemphyschem. 8, 425-432 (2007).
22. Irikura, K. K. & Goddard, W. A. Energetics of third-row transition metal methylidene ions MCH2 \+ (M 14 La, Hf, Ta, W, Re, Os, Ir, Pt, Au). J. Am. Chem. Soc. 116, 8733-8740 (1994). (Pubitemid 24981608)
23. Schwarz, H. Relativisitic effects in gas-phase ion chemistry: an experimentalist's view. Angew. Chem. Int. Ed. 42, 4442-4454 (2003). (Pubitemid 37220032)
24. Pyykkö, P. & Tamm, T. Can triple bonds exist between gold and main-group elements? Theor. Chem. Acc. 99, 113-115 (1998).
25. Barysz, M. & Pyykkö, P. Strong chemcial bonds to gold. High level correlated relativistic results for diatomic AuBe\+, AuC\+, AuMg\+, and AuSi\+. Chem. Phys. Lett. 285, 398-403 (1998). (Pubitemid 128339122)
26. Puzzarini, C. & Peterson, K. A. Multiple bonds to gold: a theoretical investigation of XAuC (X 14 F, Cl, Br, I) molecules. Chem. Phys. 311, 177-186 (2005). (Pubitemid 40305246)
27. Cho, H. G. & Andrews, L. Infrared spectra of CH3-MF and several fragments prepared by methyl fluoride reactions with laser-ablated Cu, Ag, and Au atoms. Inorg. Chem. 50, 10319-10327 (2011).
28. Hu, H. S., Qiu, Y. H., Xiong, X. G., Schwarz, W. H. E. & Li, J. On the maximum bond multiplicity of carbon: unusual C:U quadruple bonding in molecular CUO. Chem. Sci. 3, 2786-2796 (2012).
29. Jacobsen, H. & Ziegler, T. Nonclassical double-bonds in ethylene analogs-influence of Pauli repulsion on trans-bending and p-bond strength-a densityfunctional study. J. Am. Chem. Soc. 116, 3667-3679 (1994).
30. Ernst, R. D. et al. Longer but stronger bonds: structures of PF3, P(OEt)3, and PMe3 adducts of an open titanocene. J. Am. Chem. Soc. 117, 5075-5081 (1995).
31. Jacobsen, H. & Ziegler, T. The role of Pauli repulsion in mutipple bonding: structural consequences and energetic implications. Comments Inorg. Chem. 17, 301-317 (1995).
32. Kaupp, M., Metz, B. & Stoll, H. Breakdown of bond length-bond strength correlation: a case study. Angew. Chem. Int. Ed. 39, 4607-4609 (2000). (Pubitemid 32059121)
33. Cotton, F. A. Synergic interplay of experiment and theory in studying metalmetal bonds of various orders. Chem. Soc. Rev. 12, 35-51 (1983).
34. Wang, L. S., Ding, C. F., Wang, X. B. & Barlow, S. E. Photodetachment photoelectron spectroscopy of multiply charged anions using electrospray ionization. Rev. Sci. Instrum. 70, 1957-1966 (1999). (Pubitemid 129579146)
35. Wang, X. B. & Wang, L. S. Development of a low-temperature photoelectron spectroscopy instrument using an electrospray ion source and a cryogenically controlled ion trap. Rev. Sci. Instrum. 79, 073108 (2008).
36. Dau, P. D., Liu, H. T., Huang, D. L. & Wang, L. S. Photoelectron spectroscopy of cold UF5-. J. Chem. Phys. 137, 116101 (2012).
37. Perdew, J. P., Burke, K. & Ernzerhof, M. Generalized gradient approximation made simple. Phys. Rev. Lett. 77, 3865-3868 (1996). (Pubitemid 126631804)
38. Becke, A. D. Density-functional thermochemistry. 3. The role of exact exchange. J. Chem. Phys. 98, 5648-5652 (1993).
39. Lee, C. T., Yang, W. T. & Parr, R. G. Development of the Colle-Salvetti correlation-energy formula into a functional of the electron-density. Phys. Rev. B 37, 785-789 (1988).
40. ADF 2010.01, http://www.scm.com.
41. Van Lenthe, E., van Leeuwen, R., Baerends, E. J. & Snijders, J. G. Relativistic regular two-component Hamiltonians. Int. J. Quantum Chem. 57, 281-293 (1996). (Pubitemid 126519814)
42. Werner, H. J. MOLPRO, version 2008.1, http://www.molpro.net.
43. Frisch, M. J. et al. Gaussian 09, Revision A.02 (Gaussian, Inc., Wallingford CT, 2009).
44. Peterson, K. A. & Puzzarini, C. Systematically convergent basis sets for transition metals. II. Pseudopotential-based correlation consistent basis sets for the group 11 (Cu, Ag, Au) and 12 (Zn, Cd, Hg) elements. Theor. Chem. Acc. 114, 283-296 (2005). (Pubitemid 41430492)
45. Dunning, T. H. Gaussian-basis sets for use in correlated molecular calculations. 1. The atoms boron through neon and hydrogen. J. Chem. Phys. 90, 1007-1023 (1989).
46. Woon, D. E. & Dunning, T. H. Gaussian-basis sets for use in correlated molecular calculations. 3. The atoms aluminum through argon. J. Chem. Phys. 98, 1358-1371 (1993).
47. Peterson, K. A., Shepler, B. C., Figgen, D. & Stoll, H. On the spectroscopic and thermochemical properties of ClO, BrO, IO, and their anions. J. Phys. Chem. A 110, 13877-13883 (2006). (Pubitemid 46133407)
48. Figgen, D., Rauhut, G., Dolg, M. & Stoll, H. Energy-consistent pseudopotentials for group 11 and 12 atoms: adjustment to multi-configuration Dirac-Hartree-Fock data. Chem. Phys. 311, 227-244 (2005). (Pubitemid 40298945)
49. Tsuneda, T., Song, J. W., Suzuki, S. & Hirao, K. On Koopmans' theorem in density functional theory. J. Chem. Phys. 133, 174101 (2010).
50. Purvis, G. D. & Bartlett, R. J. A full coupled-cluster singles and doubles model-the inclusion of disconnected triples. J. Chem. Phys. 76, 1910-1918 (1982).