Bis(pentafluorophenyl)borinic acid: a cyclic trimer in the solid state and a monomer, with hindered rotation around the B-OH bond, in solution

被引:38
作者
Beringhelli, T
D'Alfonso, G
Donghi, D
Maggioni, D
Mercandelli, P
Sironi, A
机构
[1] Dipartimento Chim Inorgan Metallorgan & Analit, I-20133 Milan, Italy
[2] Dipartimento Chim Strutturale & Stereochim Inorga, I-20133 Milan, Italy
[3] ISTM, CNR, I-20133 Milan, Italy
关键词
D O I
10.1021/om0300732
中图分类号
O61 [无机化学];
学科分类号
070301 ; 081704 ;
摘要
The title molecule in the solid state exists as a cyclic trimer, with B-O(H)-B bridges and a cyclohexane-like structure (C-2 (twist-boat conformation); dissolution in toluene-d)(8) (affords the B(C)(F)())(OH monomer, in which the low-temperature 19F NMR data reveal restricted rotation of the OH substituent around the Ar)(B-OH bond (E)(6)(5)(2)(2)(a) = 39 kJ mol-1), as a result of the partial double-bond character of this interaction.
引用
收藏
页码:1588 / 1590
页数:3
相关论文
共 40 条
[1]   SIR97:: a new tool for crystal structure determination and refinement [J].
Altomare, A ;
Burla, MC ;
Camalli, M ;
Cascarano, GL ;
Giacovazzo, C ;
Guagliardi, A ;
Moliterni, AGG ;
Polidori, G ;
Spagna, R .
JOURNAL OF APPLIED CRYSTALLOGRAPHY, 1999, 32 :115-119
[2]   PI-ELECTRONIC STRUCTURES OF SOME COMPOUNDS CONTAINING BORON-OXYGEN BONDS .I. COMPOUNDS WHERE BORON IS NOT IN A RING [J].
ARMSTRON.DR ;
PERKINS, PG .
JOURNAL OF THE CHEMICAL SOCIETY A -INORGANIC PHYSICAL THEORETICAL, 1967, (01) :123-&
[3]   SELF-CONSISTENT MOLECULAR ORBITAL CALCULATIONS ON ORGANOBORON COMPOUNDS .4. DIPHENYLBORANES [J].
ARMSTRONG, DR ;
PERKINS, PG .
THEORETICA CHIMICA ACTA, 1966, 5 (03) :222-+
[4]   PI-ELECTRONIC STRUCTURES OF SOME COMPOUNDS CONTAINING BORON-OXYGEN BONDS .2. CYCLIC COMPOUNDS [J].
ARMSTRONG, DR ;
PERKINS, PG .
JOURNAL OF THE CHEMICAL SOCIETY A -INORGANIC PHYSICAL THEORETICAL, 1967, (05) :790-+
[5]   Aqua, alcohol, and acetonitrile adducts of tris(perfluorophenyl)borane: Evaluation of Bronsted acidity and ligand lability with experimental and computational methods [J].
Bergquist, C ;
Bridgewater, BM ;
Harlan, CJ ;
Norton, JR ;
Friesner, RA ;
Parkin, G .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2000, 122 (43) :10581-10590
[6]   1H and 19F NMR investigation of the reaction of B(C6F5)3 with water in toluene solution [J].
Beringhelli, T ;
Maggioni, D ;
D'Alfonso, G .
ORGANOMETALLICS, 2001, 20 (23) :4927-4938
[7]  
BOHNEN H, 1999, Patent No. 19733017
[8]  
BOHNEN H, 2000, Patent No. 0017208
[9]   Reversible adduct formation between phosphines and triarylboron compounds [J].
Bradley, DC ;
Harding, IS ;
Keefe, AD ;
Motevalli, M ;
Zheng, DH .
JOURNAL OF THE CHEMICAL SOCIETY-DALTON TRANSACTIONS, 1996, (20) :3931-3936
[10]   POLYFLUOROARYL ORGANOMETALLIC COMPOUNDS .2. PENTAFLUOROPHENYLBORON HALIDES AND SOME DERIVED COMPOUNDS [J].
CHAMBERS, RD ;
CHIVERS, T .
JOURNAL OF THE CHEMICAL SOCIETY, 1965, (JUL) :3933-&