Unknown

Dataset Information

0

rac-1-(4-tert-Butyl-phen-yl)-5-ethyl-4-ferrocenyl-5-hy-droxy-1H-pyrrol-2(5H)-one.


ABSTRACT: The title compound, [Fe(C5H5)(C21H24NO2)], which is produced by the oxidation of 1-(4-tert-butyl-phen-yl)-2-ethyl-3-ferrocenyl-pyrrole, crystallizes as a racemic mixture in the centrosymmetric space group P21/n. The central heterocyclic pyrrole ring system subtends dihedral angles of 13.7 (2)° with respect to the attached cyclo-penta-dienyl ring and of 43.6 (7)° with the major component of the disordered phenyl group bound to the N atom. The 4-tert-butyl-phenyl group, as well as the non-substituted Cp ring are disordered with s.o.f. values of 0.589 (16) and 0.411 (16), respectively. In the crystal, mol-ecules with the same absolute configuration are linked into infinite chains along the b-axis direction by O-H⋯O hydrogen bonds between the hy-droxy substituent and the carbonyl O atom of the adjacent mol-ecule.

SUBMITTER: Biletzki T 

PROVIDER: S-EPMC10088329 | biostudies-literature | 2023 Mar

REPOSITORIES: biostudies-literature

altmetric image

Publications

<i>rac</i>-1-(4-<i>tert</i>-Butyl-phen-yl)-5-ethyl-4-ferrocenyl-5-hy-droxy-1<i>H</i>-pyrrol-2(5<i>H</i>)-one.

Biletzki Tobias T   Görls Helmar H   Imhof Wolfgang W  

Acta crystallographica. Section E, Crystallographic communications 20230307 Pt 4


The title compound, [Fe(C<sub>5</sub>H<sub>5</sub>)(C<sub>21</sub>H<sub>24</sub>NO<sub>2</sub>)], which is produced by the oxidation of 1-(4-<i>tert</i>-butyl-phen-yl)-2-ethyl-3-ferrocenyl-pyrrole, crystallizes as a racemic mixture in the centrosymmetric space group <i>P</i>2<sub>1</sub>/<i>n</i>. The central heterocyclic pyrrole ring system subtends dihedral angles of 13.7 (2)° with respect to the attached cyclo-penta-dienyl ring and of 43.6 (7)° with the major component of the disordered pheny  ...[more]

Similar Datasets

| S-EPMC3770402 | biostudies-literature
| S-EPMC2983491 | biostudies-literature
| S-EPMC2977772 | biostudies-literature
| S-EPMC3470240 | biostudies-literature
| S-EPMC4456381 | biostudies-literature
| S-EPMC3213575 | biostudies-literature
| S-EPMC3998320 | biostudies-literature
| S-EPMC3470241 | biostudies-literature
| S-EPMC3515192 | biostudies-literature
| S-EPMC3588931 | biostudies-literature