1,4,7-Triazacyclononane hemihydrate

被引:3
作者
Battle, AR [1 ]
Johnson, DL [1 ]
Martin, LL [1 ]
机构
[1] Monash Univ, Sch Chem, Clayton, Vic 3800, Australia
关键词
D O I
10.1107/S1600536805000814
中图分类号
O7 [晶体学];
学科分类号
0702 ; 070205 ; 0703 ; 080501 ;
摘要
The title compound, C6H15N3.0.5H(2)O, crystallizes in the high-symmetry trigonal space group P(3) over bar c1. This is, after more than 30 years of effort on this compound, the first reported structure of the free base of this macrocycle. Six N-H...O hydrogen bonds are formed between the water O atom occupying a special site at the origin and N atoms of six neighbouring 1,4,7-triazacyclononane molecules.
引用
收藏
页码:O330 / O332
页数:3
相关论文
共 17 条
[1]   Phenoxyl radical complexes of gallium, scandium, iron and manganese [J].
Adam, B ;
Bill, E ;
Bothe, E ;
Goerdt, B ;
Haselhorst, G ;
Hildenbrand, K ;
Sokolowski, A ;
Steenken, S ;
Weyhermuller, T ;
Wieghardt, K .
CHEMISTRY-A EUROPEAN JOURNAL, 1997, 3 (02) :308-319
[2]   The Cambridge Structural Database: a quarter of a million crystal structures and rising [J].
Allen, FH .
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE, 2002, 58 (3 PART 1) :380-388
[3]   Selective derivatisation of aza macrocycles [J].
Blake, AJ ;
Fallis, IA ;
Gould, RO ;
Parsons, S ;
Ross, SA ;
Schroder, M .
JOURNAL OF THE CHEMICAL SOCIETY-DALTON TRANSACTIONS, 1996, (23) :4379-4387
[4]   STACKED AMIDO MACROCYCLIC COMPLEXES - SYNTHESIS AND SINGLE-CRYSTAL X-RAY STRUCTURE OF NA[CU(L)(NCME)](BF4)(2)(NO3) [L=1-FORMYL-4,7-BIS(2-HYDROXY-2-METHYLPROPYL,4,7-TRIAZACYCLONONANE] [J].
BLAKE, AJ ;
FALLIS, IA ;
GOULD, RO ;
PARSONS, S ;
ROSS, SA ;
SCHRODER, M .
JOURNAL OF THE CHEMICAL SOCIETY-CHEMICAL COMMUNICATIONS, 1994, (21) :2467-2469
[5]   Synthesis, structure and characterisation of amido derivatives of [9]aneN(3) (1,4,7-triazacyclononane) [J].
Blake, AJ ;
Fallis, IA ;
Heppeler, A ;
Parsons, S ;
Ross, SA ;
Schroder, M .
JOURNAL OF THE CHEMICAL SOCIETY-DALTON TRANSACTIONS, 1996, (01) :31-43
[6]   THE CHEMISTRY OF 1,4,7-TRIAZACYCLONONANE AND RELATED TRIDENTATE MACROCYCLIC-COMPOUNDS [J].
CHAUDHURI, P ;
WIEGHARDT, K .
PROGRESS IN INORGANIC CHEMISTRY, 1987, 35 :329-436
[7]   MACROCYCLIC LIGANDS WITH PENDANT PHOSPHONIC ACID GROUPS [J].
CLEGG, W ;
IVESON, PB ;
LOCKHART, JC .
JOURNAL OF THE CHEMICAL SOCIETY-DALTON TRANSACTIONS, 1992, (23) :3291-3298
[8]   Characterisation of a coordinated imidazole as a structural model for superoxide dismutase [J].
Daly, RI ;
Martin, LL .
INORGANIC CHEMISTRY COMMUNICATIONS, 2002, 5 (10) :777-781
[10]  
Farrugia L. J., 1999, J. Appl. Crystallogr, V32, P837, DOI DOI 10.1107/S0021889899006020