Synthesis, crystal structure and Hirshfeld surface analysis of 1-ferrocenylundecane-1,11-diol

被引：0

作者：

McAdam, C. John ^{[1
]}

Simpson, Jim ^{[1
]}

机构：

[1] Univ Otago, Dept Chem, POB 56, Dunedin, New Zealand

来源：

ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS | 2022年 / 78卷

关键词：

crystal structure; ferrocene; undecane-1; 11-diol; hydrogen bonds; C-H center dot center dot center dot pi contact; Hirshfeld surface analysis;

D O I：

10.1107/S205698902101358X

中图分类号：

O7 [晶体学];

学科分类号：

0702 ; 070205 ; 0703 ; 080501 ;

摘要：

The racemic title compound, [Fe(C5H5)(C16H27O2)], comprises an alpha,omega-diol-substituted undecyl chain with a ferrocenyl substituent at at one terminus. The alkane chain is inclined to the substituted ring of the ferrocene grouping by 84.22 (13)degrees. The ferrocene rings are almost eclipsed and parallel. The crystal structure features O-H center dot center dot center dot O and C-H center dot center dot center dot O hydrogen bonds and C-H center dot center dot center dot pi contacts that stack the molecules along the c-axis direction. A Hirshfeld surface analysis reveals that H center dot center dot center dot H interactions (83.2%) dominate the surface contacts.

引用

页码：149 / +

页数：11

共 28 条

[11] HYDROBORATION OF FERROCENYLALKENES - MECHANISTIC AND SYNTHETIC ASPECTS [J].

LOSTERZO, C ;

ORTAGGI, G .

JOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 2, 1984, (03) :345-348

[12] Mercury 4.0: from visualization to analysis, design and prediction [J].

Macrae, Clare F. ;

Sovago, Ioana ;

Cottrell, Simon J. ;

Galek, Peter T. A. ;

McCabe, Patrick ;

Pidcock, Elna ;

Platings, Michael ;

Shields, Greg P. ;

Stevens, Joanna S. ;

Towler, Matthew ;

Wood, Peter A. .

JOURNAL OF APPLIED CRYSTALLOGRAPHY, 2020, 53 :226-235

[13] Structural diversity, but no polymorphism, in a homologous family of co-crystals of urea and α,ω-dihydroxyalkanes [J].

Marti-Rujas, Javier ;

Kariuki, Benson M. ;

Hughes, Colan E. ;

Morte-Rodenas, Anabel ;

Guo, Fang ;

Glavcheva-Laleva, Zornitza ;

Tastemuer, Kemal ;

Ooi, Li-ling ;

Yeo, Lily ;

Harris, Kenneth D. M. .

NEW JOURNAL OF CHEMISTRY, 2011, 35 (07) :1515-1521

[14] Neo-Pentyl-Ferrocene Based Electroactive Polyesters [J].

McAdam, C. John ;

Nafady, Ayman ;

Bond, Alan M. ;

Moratti, Stephen C. ;

Simpson, Jim .

JOURNAL OF INORGANIC AND ORGANOMETALLIC POLYMERS AND MATERIALS, 2008, 18 (04) :485-490

[15] A neo-pentyl-ferrocene motif for the synthesis of electroactive polyesters [J].

McAdam, C. John ;

Moratti, Stephen C. ;

Robinson, Brian H. ;

Simpson, Jim .

JOURNAL OF ORGANOMETALLIC CHEMISTRY, 2008, 693 (16) :2715-2722

[16] 11-Bromo-1-ferrocenylundecan-1-one [J].

McAdam, C. John ;

Robinson, Brian H. ;

Simpson, Jim .

ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS, 2007, 63 :M1362-U96

[17] 1,11-undecanediol [J].

Nakamura, N ;

Setodoi, S ;

Ikeya, T .

ACTA CRYSTALLOGRAPHICA SECTION C-CRYSTAL STRUCTURE COMMUNICATIONS, 1999, 55 :789-791

[18] FORMATION OF ORGANIC THIN-FILMS BY ELECTROLYSIS OF SURFACTANTS WITH THE FERROCENYL MOIETY [J].

SAJI, T ;

HOSHINO, K ;

ISHII, Y ;

GOTO, M .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1991, 113 (02) :450-456

[19] Synthesis of chiral ferrocenyl-substituted β-amino cyclopentadienes and their complexation to transition metals [J].

Schwink, L ;

Knochel, P ;

Eberle, T ;

Okuda, J .

ORGANOMETALLICS, 1998, 17 (01) :7-9

[20] A short history of SHELX [J].

Sheldrick, George M. .

ACTA CRYSTALLOGRAPHICA A-FOUNDATION AND ADVANCES, 2008, 64 :112-122

← 1 2 3 →