[7,13-Bis(2-aminobenzyl)-1,4,10-trioxa-7,13-diazacyclopentadecane]diisothiocyanatobarium(II)

Fernando Avecilla; David Esteban; Carlos Platas-Iglesias; Andres De Blas; Teresa Rodríguez-Blas

doi:10.1107/s0108270102021571

[7,13-Bis(2-aminobenzyl)-1,4,10-trioxa-7,13-diazacyclopentadecane]diisothiocyanatobarium(II)

Acta Crystallogr C. 2003 Jan;59(Pt 1):m16-7. doi: 10.1107/s0108270102021571. Epub 2002 Dec 10.

Authors

Fernando Avecilla¹, David Esteban, Carlos Platas-Iglesias, Andres De Blas, Teresa Rodríguez-Blas

Affiliation

¹ Departamento de Química Fundamental, Universidade da Coruña, Campus da Zapateira s/n, E-15071 A Coruña, Spain.

PMID: 12506216
DOI: 10.1107/s0108270102021571

Abstract

The X-ray crystal structure of the title complex, [Ba(NCS)(2)(C(24)H(36)N(4)O(3))], indicates that the Ba(II) cation is nine-coordinate in the solid state, being fully encapsulated by the organic receptor ligand. The receptor adopts a syn arrangement, with both pendant arms oriented on the same side of the crown moiety. The distance between the two amine N atoms is 3.911 (12) A, while the pivotal N atoms are 5.322 (10) A apart.