Intriguing μ -μ interaction in crystal packing
Journal of Physical Chemistry B, ISSN: 1520-5207, Vol: 114, Issue: 12, Page: 4166-4170
2010
- 56Citations
- 19Captures
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Metrics Details
- Citations56
- Citation Indexes56
- 56
- CrossRef48
- Captures19
- Readers19
- 19
Article Description
The μ -μ interactions are utilized to design the solid-state assembly of host-guest complexes where guests are anions. The doubly protonated MPTPH2 (MPTP = 4′-(4-methoxyphenyl)-2,2′:6′, 2"-terpyridine) complexed with HO and Cl or Br are synthesized, crystallized, and characterized by X-ray analysis. By using the density functional theory calculations which can properly describe the dispersion energy, the assembling phenomena are analyzed in terms of μ-μ and μ-μ interactions as well as H-bonding interactions. The planar structure of MPTPH(Cl)· 2HO or MPTPH(Br)·2HO facilitates the crystal packing, since the μ-μ interactions play an important role in the solid-state assembly. © 2010 American Chemical Society.
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