{"database":"biostudies-literature","file_versions":[],"scores":null,"additional":{"omics_type":["Unknown"],"volume":["67(Pt 10)"],"submitter":["Schuecker R"],"pubmed_abstract":["The racemic title compound, [FePdCl(2)(C(5)H(5))(C(36)H(29)P(2))]·2(CH(3))(2)SO, features a Pd-chelating 1,3-diphosphine, which is substituted at a P-bearing asymmetric C atom by a ferrocenyl group. The Pd(II) atom is in a distorted quadratic coordination by two P and two Cl atoms with bond lengths of 2.2414 (3) and 2.2438 (3) Å for Pd-P, and 2.3452 (3) and 2.3565 (3) Å for Pd-Cl. The conformation of the Pd complex is controlled by an intra-molecular slipped π-π stacking inter-action between a phenyl and a cyclo-penta-dienyl ring with corresponding C⋯C distances starting at 3.300 (2) Å and the distance between ring centroids being 3.674 (2) Å. The crystal structure is stabilized by C-H⋯Cl and C-H⋯O hydrogen bonds. The (CH(3))(2)SO solvent mol-ecules are arranged in layers parallel to (101) and are linked in pairs by C-H⋯O inter-actions. One (CH(3))(2)SO mol-ecule is orientationally disordered [occupancy ratio 0.8766 (17):0.1234 (17)] with sulfur in two positions at both sides of its C(2)O triangle."],"journal":["Acta crystallographica. Section E, Structure reports online"],"pagination":["m1377-8"],"full_dataset_link":["https://www.ebi.ac.uk/biostudies/studies/S-EPMC3201499"],"repository":["biostudies-literature"],"pubmed_title":["rac-Dichlorido(1-{(diphenyl-phosphan-yl)[2-(diphenyl-phosphan-yl)phen-yl]meth-yl}ferrocene-κP,P')palladium(II) dimethyl sulfoxide disolvate."],"pmcid":["PMC3201499"],"pubmed_authors":["Schuecker R","Weissensteiner W","Mereiter K"],"additional_accession":[]},"is_claimable":false,"name":"rac-Dichlorido(1-{(diphenyl-phosphan-yl)[2-(diphenyl-phosphan-yl)phen-yl]meth-yl}ferrocene-κP,P')palladium(II) dimethyl sulfoxide disolvate.","description":"The racemic title compound, [FePdCl(2)(C(5)H(5))(C(36)H(29)P(2))]·2(CH(3))(2)SO, features a Pd-chelating 1,3-diphosphine, which is substituted at a P-bearing asymmetric C atom by a ferrocenyl group. The Pd(II) atom is in a distorted quadratic coordination by two P and two Cl atoms with bond lengths of 2.2414 (3) and 2.2438 (3) Å for Pd-P, and 2.3452 (3) and 2.3565 (3) Å for Pd-Cl. The conformation of the Pd complex is controlled by an intra-molecular slipped π-π stacking inter-action between a phenyl and a cyclo-penta-dienyl ring with corresponding C⋯C distances starting at 3.300 (2) Å and the distance between ring centroids being 3.674 (2) Å. The crystal structure is stabilized by C-H⋯Cl and C-H⋯O hydrogen bonds. The (CH(3))(2)SO solvent mol-ecules are arranged in layers parallel to (101) and are linked in pairs by C-H⋯O inter-actions. One (CH(3))(2)SO mol-ecule is orientationally disordered [occupancy ratio 0.8766 (17):0.1234 (17)] with sulfur in two positions at both sides of its C(2)O triangle.","dates":{"release":"2011-01-01T00:00:00Z","publication":"2011 Oct","modification":"2025-04-04T08:06:24.063Z","creation":"2019-03-26T23:59:30Z"},"accession":"S-EPMC3201499","cross_references":{"pubmed":["22064964"],"doi":["10.1107/S160053681103618X"]}}