Structure via PubChem · Public domain (PubChem)
Chemical data
- Formula
- C36H52ClMnN2O2
- Molecular weight
- 635.2 g/mol
- IUPAC name
- 2,4-ditert-butyl-6-[[(1R,2R)-2-[(3,5-ditert-butyl-2-oxidophenyl)methylideneamino]cyclohexyl]iminomethyl]phenolate;manganese(3+);chloride
- SMILES
- CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)[O-])C=N[C@@H]2CCCC[C@H]2N=CC3=C(C(=CC(=C3)C(C)(C)C)C(C)(C)C)[O-].[Cl-].[Mn+3]
- InChIKey
- LJVAWOSDJSQANR-SEILFYAJSA-K
- Polar surface area
- 70.8 Ų
- H-bond donors
- 0
- H-bond acceptors
- 5
- Formal charge
- 0
via PubChem
Wikidata facts
- Subclass of
- chemical compound
- Mass
- 634.309776684
Show 4 more facts
- canonical SMILES
- CC(C)(C)C1=CC(=C(C(=C1)C=NC2CCCCC2N=CC3=CC(=CC(=C3[O-])C(C)(C)C)C(C)(C)C)[O-])C(C)(C)C.[Cl-].[Mn+3]
- Commons category
- Jacobsen's catalyst
- isomeric SMILES
- CC(C)(C)c1cc2/C=N/[C@H]4CCCC[C@@H]4/N=C/c3cc(cc(c3O[Mn](Cl)Oc2c(c1)C(C)(C)C)C(C)(C)C)C(C)(C)C
- chemical formula
- C₃₆H₅₂ClMnN₂O₂
Sources (2)
via Wikidata · CC0