chempirical

Cyclopentadienyliron dicarbonyl dimer

C14H10Fe2O4CAS 12154-95-9353.92 g/mol

Open in Covalent MOL file
C−O+C−O+C−O−C−O−Fe3+Fe3+HC−HC−

Properties

Molecular formula
C14H10Fe2O4
Molar mass
353.92 g/mol
Exact mass
353.9278 Da
Melting point
195 °C (decomposes)
logP
0.52Crippen estimate
Polar surface area
85.9 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
0

Identifiers

CAS number
12154-95-9
SMILES
[C-]#[O+].[C-]#[O+].[C-][O-].[C-][O-].[Fe+3].[Fe+3].c1cc[cH-]c1.c1cc[cH-]c1
InChIKey
CIDIJZKXTFILKY-UHFFFAOYSA-N
InChI
InChI=1S/2C5H5.4CO.2Fe/c2*1-2-4-5-3-1;4*1-2;;/h2*1-5H;;;;;;/q2*-1;;;2*-2;2*+3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

22 names · show all
  • Iron, di-μ-carbonyldicarbonylbis(η5-2,4-cyclopentadien-1-yl)di-, (Fe-Fe)
  • Cyclopentadienylirondicarbonyl dimer
  • Bis(dicarbonyl-π-cyclopentadienyliron)
  • Dicyclopentadienyltetracarbonyldiiron
  • Bis[dicarbonyl(π-cyclopentadienyl)iron(II)]
  • Tetracarbonylbis(η5-cyclopentadienyl)diiron
  • Bis(dicarbonyl(η5-cyclopentadienyl)iron)
  • Di-μ-carbonyldicarbonylbis[(1,2,3,4,5-η)-2,4-cyclopentadien-1-yl]diiron
  • Di-μ-carbonylbis[carbonyl(η5-cyclopentadienyl)iron]
  • Di-μ-carbonyldicarbonylbis(η5-cyclopentadienyl)diiron
  • Iron, di-μ-carbonyldicarbonyldi-π-cyclopentadienyldi-, (Fe-Fe)
  • Dicyclopentadienyldiiron tetracarbonyl
  • Bis(cyclopentadienyliron dicarbonyl)
  • Bis(cyclopentadienyldicarbonyliron)
  • Bis(π-cyclopentadienylirondicarbonyl)
  • Di-μ-carbonyldicarbonyldi-π-cyclopentadienyldiiron
  • Dicyclopentadienyliron dicarbonyl dimer
  • Cyclopentadienyldicarbonyliron dimer
  • Dicarbonyl-π-cyclopentadienyliron dimer
  • Tetracarbonylbis(cyclopentadienyl)diiron
  • Bis(π-cyclopentadienyldicarbonyliron)
  • Dicarbonylcyclopentadienyliron dimer

Work with Cyclopentadienyliron dicarbonyl dimer

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Tricarbonyl(η5-cyclopentadienyl)manganese12079-65-156 % similar Dicobalt octacarbonyl10210-68-144 % similar Hexadecacarbonylhexarhodium28407-51-439 % similar Ruthenocene1287-13-438 % similar Ferrocene102-54-532 % similar Chromocene1271-24-532 % similar Nickelocene1271-28-932 % similar Cobaltocene1277-43-632 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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