dichloropalladium;diphenylphosphane;iron

C12H11Cl2FePPd — CID 175532989

IUPACdichloropalladium;diphenylphosphane;iron
SMILESCl[Pd]Cl.[Fe].c1ccc(Pc2ccccc2)cc1
InChIInChI=1S/C12H11P.2ClH.Fe.Pd/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;;;;/h1-10,13H;2*1H;;/q;;;;+2/p-2
InChIKeyHXOCXWRYBRFCIV-UHFFFAOYSA-L
MW419.37 g/mol
LogP3.69
Rot. Bonds2

About dichloropalladium;diphenylphosphane;iron

dichloropalladium;diphenylphosphane;iron (PubChem CID 175532989) has the molecular formula C12H11Cl2FePPd and a molecular weight of 419.37 g/mol. Its IUPAC name is dichloropalladium;diphenylphosphane;iron.

Molecular Properties

Compound Namedichloropalladium;diphenylphosphane;iron
PubChem CID175532989
Molecular FormulaC12H11Cl2FePPd
Molecular Weight419.37 g/mol
Exact Mass417.84
IUPAC Namedichloropalladium;diphenylphosphane;iron
SMILESCl[Pd]Cl.[Fe].c1ccc(Pc2ccccc2)cc1
InChIInChI=1S/C12H11P.2ClH.Fe.Pd/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;;;;/h1-10,13H;2*1H;;/q;;;;+2/p-2
InChIKeyHXOCXWRYBRFCIV-UHFFFAOYSA-L
XLogP3.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500419.37
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

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CID 160591319
bis(diphenylphosphane);zinc
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dichloromethane;diphenylphosphane
CID 158269242
bicyclo[2.2.2]octa-1,3,5,7-tetraene;diphenylphosphane
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CID 156694955
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CID 70153043
diphenylphosphane;phosphorous acid
CID 158763055
diphenylphosphane;iron(3+);methanone
CID 174711189
butane;dichloronickel;diphenylphosphane
CID 160852831
CID 66920881
CID 66920881

Frequently Asked Questions

What is the IUPAC name of dichloropalladium;diphenylphosphane;iron?
The IUPAC name of dichloropalladium;diphenylphosphane;iron (CID 175532989) is dichloropalladium;diphenylphosphane;iron.
What is the SMILES notation for dichloropalladium;diphenylphosphane;iron?
The canonical SMILES for dichloropalladium;diphenylphosphane;iron is Cl[Pd]Cl.[Fe].c1ccc(Pc2ccccc2)cc1.
What is the InChIKey of dichloropalladium;diphenylphosphane;iron?
The InChIKey is HXOCXWRYBRFCIV-UHFFFAOYSA-L. The full InChI is InChI=1S/C12H11P.2ClH.Fe.Pd/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;;;;/h1-10,13H;2*1H;;/q;;;;+2/p-2.
What are the key properties of dichloropalladium;diphenylphosphane;iron?
dichloropalladium;diphenylphosphane;iron has a molecular weight of 419.37 g/mol, XLogP of 3.69, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dichloropalladium;diphenylphosphane;iron is sourced from PubChem (CID 175532989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).