1-[(Ferrocen-1-yl)methyl]-3-(naphthalen-1-yl)thiourea
In the title compound, [Fe(C5H5)(C17H15N2S)], the cyclopentadienyl (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 cyclopentadienyl ring, with an Fe&...
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International Union of Crystallography
2011-12-01
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Series: | Acta Crystallographica Section E |
Online Access: | http://scripts.iucr.org/cgi-bin/paper?S1600536811046629 |
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doaj-53877250a77d4b0fb1b006dd6f7493cb2020-11-24T21:37:54ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682011-12-016712m1744m174410.1107/S16005368110466291-[(Ferrocen-1-yl)methyl]-3-(naphthalen-1-yl)thioureaXia LiWei LiuIn the title compound, [Fe(C5H5)(C17H15N2S)], the cyclopentadienyl (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 cyclopentadienyl 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 thiourea moiety are positioned anti with respect to each other. In the crystal, molecules form centrosymmetric dimers via pairs of N—H...S hydrogen bonds.http://scripts.iucr.org/cgi-bin/paper?S1600536811046629 |
collection |
DOAJ |
language |
English |
format |
Article |
sources |
DOAJ |
author |
Xia Li Wei Liu |
spellingShingle |
Xia Li Wei Liu 1-[(Ferrocen-1-yl)methyl]-3-(naphthalen-1-yl)thiourea Acta Crystallographica Section E |
author_facet |
Xia Li Wei Liu |
author_sort |
Xia Li |
title |
1-[(Ferrocen-1-yl)methyl]-3-(naphthalen-1-yl)thiourea |
title_short |
1-[(Ferrocen-1-yl)methyl]-3-(naphthalen-1-yl)thiourea |
title_full |
1-[(Ferrocen-1-yl)methyl]-3-(naphthalen-1-yl)thiourea |
title_fullStr |
1-[(Ferrocen-1-yl)methyl]-3-(naphthalen-1-yl)thiourea |
title_full_unstemmed |
1-[(Ferrocen-1-yl)methyl]-3-(naphthalen-1-yl)thiourea |
title_sort |
1-[(ferrocen-1-yl)methyl]-3-(naphthalen-1-yl)thiourea |
publisher |
International Union of Crystallography |
series |
Acta Crystallographica Section E |
issn |
1600-5368 |
publishDate |
2011-12-01 |
description |
In the title compound, [Fe(C5H5)(C17H15N2S)], the cyclopentadienyl (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 cyclopentadienyl 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 thiourea moiety are positioned anti with respect to each other. In the crystal, molecules form centrosymmetric dimers via pairs of N—H...S hydrogen bonds. |
url |
http://scripts.iucr.org/cgi-bin/paper?S1600536811046629 |
work_keys_str_mv |
AT xiali 1ferrocen1ylmethyl3naphthalen1ylthiourea AT weiliu 1ferrocen1ylmethyl3naphthalen1ylthiourea |
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1725936604062679040 |