chempirical

Dichloro[ferrocene-1,1′-diylbis(diphenylphosphine-P)]cobalt(II)

C34H28Cl2CoFeP2CAS 67292-36-8684.22 g/mol

Open in Covalent MOL file
Cl−Cl−Co2+Fe2+PHC−PHC−
Phosphine

Properties

Molecular formula
C34H28Cl2CoFeP2
Molar mass
684.22 g/mol
Exact mass
682.9725 Da
logP
0.33Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
6

Identifiers

CAS number
67292-36-8
SMILES
[Cl-].[Cl-].[Co+2].[Fe+2].c1ccc(P(c2ccccc2)c2ccc[cH-]2)cc1.c1ccc(P(c2ccccc2)c2ccc[cH-]2)cc1
InChIKey
NLCBUHMLTVFFMZ-UHFFFAOYSA-L
InChI
InChI=1S/2C17H14P.2ClH.Co.Fe/c2*1-3-9-15(10-4-1)18(17-13-7-8-14-17)16-11-5-2-6-12-16;;;;/h2*1-14H;2*1H;;/q2*-1;;;2*+2/p-2

Weigh it out

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

Names and synonyms

4 names
  • Cobalt, [1,1′-bis(diphenylphosphino-κP)ferrocene]dichloro-, (T-4)-
  • Cobalt, [1,1′-bis(diphenylphosphino)ferrocene-P,P′]dichloro-, (T-4)-
  • Ferrocene, 1,1′-bis(diphenylphosphino)-, cobalt complex
  • (1,1′-Bis(diphenylphosphino)ferrocene)dichlorocobalt

Work with Dichloro[ferrocene-1,1′-diylbis(diphenylphosphine-P)]cobalt(II)

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

(1,1'-Bis(diphenylphosphino)ferrocene)palladium(II) dichloride72287-26-482 % similar 1,1'-Bis(diphenylphosphino)ferrocene12150-46-880 % similar Dichloro[1,1′-bis(diphenylphosphino)ferrocene]palladium(II) dichloromethane adduct95464-05-469 % similar Palladium, [1,1′-bis(diphenylphosphino-κP)ferrocene]dichloro-, (sp-4-2)-, compd. with 2-propanone (1:1)851232-71-864 % similar (Sp-4-2)-[1,1′-bis[bis(1-methylethyl)phosphino-κP]ferrocene]dichloropalladium215788-65-145 % similar Chloro(cyclopentadienyl)bis(triphenylphosphine)ruthenium32993-05-843 % similar Dichlorotris(triphenylphosphine)ruthenium(II)15529-49-442 % similar Bis(triphenylphosphine)palladium chloride13965-03-241 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook