6533b820fe1ef96bd127988d

RESEARCH PRODUCT

Two atropisomers of tricarbonyl[η6-7-chloro-3-(3-chloro-2-methylphenyl)-2,4,8-trimethyl-1,2,3,4-tetrahydro-2,4-dibora-1,3-diazanaphthalene]chromium(0)

Mustapha Ait AliS. AllaoudBernard FrangeAbdallah KarimOlivier BlacqueBahija Abouhamza

subject

Eclipsed conformationAtropisomerbiologyBicyclic moleculeStereochemistryChemistryGeneral MedicineCrystal structurebiology.organism_classificationMedicinal chemistryGeneral Biochemistry Genetics and Molecular Biologychemistry.chemical_compoundTetraMoleculeMoietyNaphthalene

description

The structures of two atropisomers of the title compound, [Cr(C16H18B2Cl2N2)(CO)3], are reported. For both compounds, the Cr(CO)3 moiety is bound to the C6 aromatic ring of the mol­ecule; the existence of atropisomers resulting from the non-equivalence of both faces of the C6 aromatic ring is a consequence of the 3-chloro-2-methylphenyl ring being nearly perpendicular to the mean plane of the 2,4-dibora-1,3-di­aza­naphthalene ring. The orientation of the Cr(CO)3 tripod relative to the C6 aromatic ring is such that it is nearly eclipsed in one isomer (2.4° rotation from being eclipsed with C—N, C—Cl and C—H) and slightly twisted (16.2°) from an eclipsed conformation in the other.

https://doi.org/10.1107/s0108270101006187