Non-Planar Lithium-Phthalocyanine in the Double Salt (nBu4N)2[Lipc]PF6

被引：0

作者：

Huebner, Ralph ^{[1
]}

Kandaiah, Sakthivel ^{[1
]}

Jansen, Martin ^{[1
]}

机构：

[1] Max Planck Inst Festkorperforsch, D-70569 Stuttgart, Germany

来源：

ZEITSCHRIFT FUR ANORGANISCHE UND ALLGEMEINE CHEMIE | 2012年 / 638卷 / 10期

关键词：

Crystal structure; Double salts; Lithium; Phthalocyanine; Non-planar; Packing effects; ELECTROCHEMICAL PREPARATION; CRYSTAL-STRUCTURE; RADICALS; EPR;

D O I：

10.1002/zaac.201200276

中图分类号：

O61 [无机化学];

学科分类号：

070301 ; 081704 ;

摘要：

We report the synthesis of the diamagnetic double salt bis(tetra(n-butyl)ammonium) phthalocyanato(2-)lithate hexafluorophosphate (nBu4N)2[Lipc]PF6 [pc = phthalocyanine, nBu4N+ = tetra(n-butyl)ammonium] in dme (dme = dimethoxyethane). According to single-crystal X-ray diffraction structure analysis [P$\bar{1}$, a = 8.642(2) angstrom, b = 12.820(3) angstrom, c = 15.019(3) angstrom, a = 83.01(3)degrees, beta = 87.87(3)degrees, ? = 74.45(3)degrees, Z = 1, R1 = 6.4?%], the phthalocyanine building bloc shows a substantial distortion of the macrocyclic ring from planarity. The deviation from D4h symmetry originates from packing effects induced by the two tetra(n-butyl)ammonium cations located above and below the macrocycle. DFT structure optimization starting from the experimental non-planar configuration produces a fully planar complex anion [Lipc].

引用

页码：1478 / 1481

页数：4

共 50 条

[31] Application and modification of cyclometalated ruthenium(II) complex [Ru(o-C6H4-2-C5H4N)(MeCN)4]PF6 for atom transfer radical polymerization
Camacho, Francisco Diaz
Morales, Salvador Lopez
Le Lagadec, Ronan
Alexandrova, Larissa
MACROMOLECULAR SYMPOSIA, 2006, 242 : 25 - 33
[32] Molecular and electronic structure of square planar complexes [PdII(tbpy)(LN,OIP)]0, [PdII(tbpy)(LN,OISQ)](PF6), and [PdII(tbpy)(LN,OIBQ)](PF6)(BF4)•2CH2Cl2:: an o-iminophenolato based ligand centered, three-membered redox series
Kokatam, Swarna-Latha
Chaudhuri, Phalguni
Weyhermueller, Thomas
Wieghardt, Karl
DALTON TRANSACTIONS, 2007, (03) : 373 - 378
[33] A [4+2] mixed ligand approach to ruthenium DNA metallointercalators [Ru(tpa)(N-N)](PF6)2 using a tris(2-pyridylmethyl)amine (tpa) capping ligand
Kraft, Sabine Seeberg Nee
Bischof, Caroline
Loos, Annette
Braun, Sebastian
Jafarova, Nigar
Schatzschneider, Ulrich
JOURNAL OF INORGANIC BIOCHEMISTRY, 2009, 103 (08) : 1126 - 1134
[34] Synthesis and crystal structure of {[Mn(H2O)4(3,3′-azpy)](3,3′-azpy)3(PF6)2}n
Li, BL
Cao, ZB
Wang, SW
Xu, Z
Yu, KB
CHINESE JOURNAL OF STRUCTURAL CHEMISTRY, 2002, 21 (03) : 292 - 295
[35] Syntheses and characterization of arene ruthenium (II) complexes containing N,N′-donor Schiff base ligands.: Crystal and molecular structure of [(η6-C6Me6)Ru(C5H4N-2-CH=N-C6H4-p-NO2)]PF6
Lalrempuia, R
Kollipara, MR
Carroll, PJ
POLYHEDRON, 2003, 22 (04) : 605 - 609
[36] RH2(1,8-DIISOCYANOMENTHANE)4(PF6)2 C48H72F12N8P2RH2
MANN, KR
CRYSTAL STRUCTURE COMMUNICATIONS, 1981, 10 (02): : 451 - 457
[37] Homoleptic copper(I) and silver(I) complexes with o-phenylene-backboned bis(thioethers), bis(selenoethers), and bis(telluroethers): Synthesis, multinuclear NMR studies, and crystal structures of [Cu{o-C6H4(SeMe)(2)}(2)]PF6, [Cu{o-C6H4(TeMe)(2)}(2)]PF6, and [Ag-n{mu-o-C6H4(SeMe)(2)}(n){o-C6H4(SeMe)(2)}(n)][BF4](n)center dot nCH(2)Cl(2)
Black, JR
Champness, NR
Levason, W
Reid, G
INORGANIC CHEMISTRY, 1996, 35 (07) : 1820 - 1824
[38] REACTIVITY OF THE IRIDIUM NITROSYL COMPLEX [IR(NO)(2-PYRIDINECARBALDEHYDE AZINE)(PPH3)2][PF6]2 WITH NUCLEOPHILES - INSERTION OF NO INTO A METHINIC C-H BOND - CRYSTAL-STRUCTURE OF [IR((2-C5H4N)CH=N-N=C(NOH)(2-C5H4N))(ME(ETO)C=NH)(PPH3)2][PF6]2
GHEDINI, M
LONGERI, M
NEVE, F
LANFREDI, AMM
TIRIPICCHIO, A
JOURNAL OF THE CHEMICAL SOCIETY-DALTON TRANSACTIONS, 1989, (07): : 1217 - 1225
[39] Syntheses, hydrogen-bonded assembly structures, and spin crossover properties of [FeIII(Him)2(n-MeOhapen)]PF6 (Him = imidazole and n-MeOhapen = N,N′-bis(n-methoxy-2-oxyacetophenylidene)ethylenediamine); n=4, 5, 6)
Fujinami, Takeshi
Ikeda, Mizuki
Koike, Masataka
Matsumoto, Naohide
Oishi, Tomohiro
Sunatsuki, Yukinari
INORGANICA CHIMICA ACTA, 2015, 432 : 89 - 95
[40] Low temperature solid-state reactions of (NH4)2[MS4] (M = W, Mo) with [Cu(CH3CN)4](PF6) and CuBr in the presence of bis(diphenylphosphino)methane (dppm):: Crystal structures of [MS4Cu4(dppm)4](PF6)2 (M = W, Mo), [WS4Cu3(dppm)3]X (X = PF6,Br), [Cu3(dppm)3Br2]Br, [WS4Cu2(dppm)3], and [(n-Bu)4N][WS4Cu3Br2(dppm)2]
Lang, JP
Tatsumi, K
INORGANIC CHEMISTRY, 1998, 37 (24) : 6308 - 6316

← 1 2 3 4 5 →