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1-[(Ferrocen-1-yl)meth-yl]-3-(naphthalen-1-yl)thio-urea.

ABSTRACT: In the title compound, [Fe(C(5)H(5))(C(17)H(15)N(2)S)], the cyclo-penta-dienyl (Cp) rings are almost parallel and essentially eclipsed, with a dihedral angle between the Cp ring planes of 0.807?(11)°. The Fe atom is slightly closer to the substituted cyclo-penta-dienyl ring, with an Fe-centroid distance of 1.6510?(8)?Å, compared with 1.6597?(8)?Å for the unsubstituted ring. The bridging unit between the substituted Cp ring and the naphthyl ring system is planar within 0.0174?Å and makes dihedral angles of 59.032?(10) and 66.02?(2)°, respectively, with these two rings. The angle between the substituted Cp ring and the naphthyl ring system is 72.094?(18)°. The H atoms of the NH groups of the thio-urea moiety are positioned anti with respect to each other. In the crystal, mol-ecules form centrosymmetric dimers via pairs of N-H?S hydrogen bonds.

SUBMITTER: Li X

PROVIDER: S-EPMC3238652 | biostudies-literature | 2011 Dec

REPOSITORIES: biostudies-literature

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1-[(Ferrocen-1-yl)meth-yl]-3-(naphthalen-1-yl)thio-urea.

Li Xia X Liu Wei W

Acta crystallographica. Section E, Structure reports online 20111112 Pt 12

In the title compound, [Fe(C(5)H(5))(C(17)H(15)N(2)S)], the cyclo-penta-dienyl (Cp) rings are almost parallel and essentially eclipsed, with a dihedral angle between the Cp ring planes of 0.807 (11)°. The Fe atom is slightly closer to the substituted cyclo-penta-dienyl ring, with an Fe-centroid distance of 1.6510 (8) Å, compared with 1.6597 (8) Å for the unsubstituted ring. The bridging unit between the substituted Cp ring and the naphthyl ring system is planar within 0.0174 Å and makes dihedral ...[more]

PMID: 22199543

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