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Crystal structure of {[1'-(di-phenyl-phosphino)ferrocen-yl]meth-yl}di-methyl-ammonium chloride monohydrate.

ABSTRACT: Individual ions and the solvating water mol-ecule constituting the structure of the title compound, [Fe(C₈H₁₃N)(C₁₇H₁₄P)]Cl·H₂O, assemble into dimeric units located around crystallographic inversion centers via N-H?Cl and O-H?Cl hydrogen bonds. These discrete fragments are further inter-connected into chains by C-H?O inter-actions. The disubstituted ferrocene core in the {[1'-(di-phenyl-phosphino)ferrocen-yl]meth-yl}di-methyl-ammonium cation has an approximate synclinal eclipsed conformation and is tilted by 3.40?(11)°.

SUBMITTER: Zabransky M

PROVIDER: S-EPMC5730313 | biostudies-literature | 2017 Oct

REPOSITORIES: biostudies-literature

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Crystal structure of {[1'-(di-phenyl-phosphino)ferrocen-yl]meth-yl}di-methyl-ammonium chloride monohydrate.

Zábranský Martin M Štěpnička Petr P

Acta crystallographica. Section E, Crystallographic communications 20170925 Pt 10

Individual ions and the solvating water mol-ecule constituting the structure of the title compound, [Fe(C8H13N)(C17H14P)]Cl·H2O, assemble into dimeric units located around crystallographic inversion centers via N-H⋯Cl and O-H⋯Cl hydrogen bonds. These discrete fragments are further inter-connected into chains by C-H⋯O inter-actions. The disubstituted ferrocene core in the {[1'-(di-phenyl-phosphino)ferrocen-yl]meth-yl}di-methyl-ammonium ...[more]

PMID: 29250376

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