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(S)-1-(1-Ferrocenylmethyl-1H-benz-imidazol-2-yl)ethanol monohydrate.

ABSTRACT: In the structure of the title compound, [Fe(C(5)H(5))(C(15)H(15)N(2)O)]·H(2)O, the unsubstituted cyclo-penta-diene (Cp) ring is disordered over two positions, with site-occupancy factors of 0.636?(12) and 0.364?(12). The dihedral angles between the planes of the substituted Cp ring and the major and minor components of the disordered ring are 0.8?(3) and 3.4?(6)°, respectively. The crystal packing is stabilized by inter-molecular O-H?O hydrogen bonds, forming zigzag chains running parallel to the a axis.

SUBMITTER: Xia R 

PROVIDER: S-EPMC2969406 | biostudies-other | 2009

REPOSITORIES: biostudies-other

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(S)-1-(1-Ferrocenylmethyl-1H-benz-imidazol-2-yl)ethanol monohydrate.

Xia Rong R  

Acta crystallographica. Section E, Structure reports online 20090627 Pt 7

In the structure of the title compound, [Fe(C(5)H(5))(C(15)H(15)N(2)O)]·H(2)O, the unsubstituted cyclo-penta-diene (Cp) ring is disordered over two positions, with site-occupancy factors of 0.636 (12) and 0.364 (12). The dihedral angles between the planes of the substituted Cp ring and the major and minor components of the disordered ring are 0.8 (3) and 3.4 (6)°, respectively. The crystal packing is stabilized by inter-molecular O-H⋯O hydrogen bonds, forming zigzag chains running parallel to th  ...[more]