[6]Helicene as a novel molecular tweezer for the univalent silver cation: Experimental and theoretical study

Klepetářová, B.; Makrlík, E.; Jaklová Dytrtová, Jana; Böhm, S.; Vaňura, P.; Storch, Jan

doi:https://dx.doi.org/10.1016/j.molstruc.2015.04.022

Number of the records: 1

[6]Helicene as a novel molecular tweezer for the univalent silver cation: Experimental and theoretical study

1.

SYSNO ASEP	0446734
Document Type	J - Journal Article
R&D Document Type	The record was not marked in the RIV
Subsidiary J	Článek ve WOS
Title	[6]Helicene as a novel molecular tweezer for the univalent silver cation: Experimental and theoretical study
Author(s)	Klepetářová, B. (CZ) Makrlík, E. (CZ) Jaklová Dytrtová, Jana (UOCHB-X)_{RID, ORCID} Böhm, S. (CZ) Vaňura, P. (CZ) Storch, Jan (UCHP-M)_{RID, ORCID, SAI}
Number of authors	6
Source Title	Journal of Molecular Structure. - : Elsevier - ISSN 0022-2860 Roč. 1097, Oct 5 (2015), s. 124-128
Number of pages	5 s.
Language	eng - English
Country	NL - Netherlands
Keywords	univalent silver cation ; [6]helicene ; cation-pi interaction ; structures
Subject RIV	CF - Physical ; Theoretical Chemistry
R&D Projects	GP13-21409P GA ČR - Czech Science Foundation (CSF)
	GAP207/10/1124 GA ČR - Czech Science Foundation (CSF)
	TA01010646 GA TA ČR - Technology Agency of the Czech Republic (TA ČR)
	FR-TI3/628 GA MPO - Ministry of Industry and Trade (MPO)
Institutional support	UOCHB-X - RVO:61388963 ; UCHP-M - RVO:67985858
UT WOS	000358555700017
EID SCOPUS	84930206536
DOI	10.1016/j.molstruc.2015.04.022
Annotation	By employing electrospray ionization mass spectrometry (ES1-MS), it was proven experimentally that the [6]helicene-Ag+ complex (i.e.. (Ag(C26H16)](+)) exists in the gas phase. Further, applying quantum mechanical OFT calculations, the most probable structure of this cationic complex [Ag(C26H16)](+) was derived. Finally, in the solid state, the complex [6]helicene-silver perchlorate-monohydrate (i.e., C26H16-AgClO4-H2O), crystallizing in the monoclinic system with the centro-symmetric P2(1/)c space group, was prepared and analyzed by X-ray crystallography.
Workplace	Institute of Organic Chemistry and Biochemistry
Contact	asep@uochb.cas.cz ; Kateřina Šperková, Tel.: 232 002 584 ; Jana Procházková, Tel.: 220 183 418
Year of Publishing	2016

Number of the records: 1