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3,7,11,19,23,27-Hexaaza-tricyclo-[27.3.1.1]tetra-triaconta-1(32),13,15,17(34),29(33),30-hexa-ene hexa-chloride tetra-hydrate.

ABSTRACT: The title compound, C(28)H(52)N(6) (6+)·6Cl(-)·4H(2)O, is a dinucleating 28-membered centrosymmetric hexa-azamacrocyclic complex. The macrocyclic ligand adopts a chair-like conformation, with the crystallographic inversion center located in the macrocyclic cavity. The six chloride ions and four water mol-ecules are situated symmetrically outside the macrocyclic cavity. The crystal structure is stabilized by N-H?Cl, N-H?O and O-H?Cl hydrogen bonds.

SUBMITTER: Liu HY

PROVIDER: S-EPMC2915196 | biostudies-literature | 2007 Dec

REPOSITORIES: biostudies-literature

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3,7,11,19,23,27-Hexaaza-tricyclo-[27.3.1.1]tetra-triaconta-1(32),13,15,17(34),29(33),30-hexa-ene hexa-chloride tetra-hydrate.

Liu Hai-Yan HY Wei Guo-Hua GH Ma Jian-Fang JF

Acta crystallographica. Section E, Structure reports online 20071206 Pt 1

The title compound, C(28)H(52)N(6) (6+)·6Cl(-)·4H(2)O, is a dinucleating 28-membered centrosymmetric hexa-azamacrocyclic complex. The macrocyclic ligand adopts a chair-like conformation, with the crystallographic inversion center located in the macrocyclic cavity. The six chloride ions and four water mol-ecules are situated symmetrically outside the macrocyclic cavity. The crystal structure is stabilized by N-H⋯Cl, N-H⋯O and O-H⋯Cl hydrogen bonds. ...[more]

PMID: 21200690

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