iron(2+);oxygen(2-);zirconium

FeOZr — CID 175724896

IUPACiron(2+);oxygen(2-);zirconium
SMILES[Fe+2].[O-2].[Zr]
InChIInChI=1S/Fe.O.Zr/q+2;-2;
InChIKeyNPLLLADUNACAGJ-UHFFFAOYSA-N
MW163.07 g/mol
LogP-0.12
Rot. Bonds

About iron(2+);oxygen(2-);zirconium

iron(2+);oxygen(2-);zirconium (PubChem CID 175724896) has the molecular formula FeOZr and a molecular weight of 163.07 g/mol. Its IUPAC name is iron(2+);oxygen(2-);zirconium.

Molecular Properties

Compound Nameiron(2+);oxygen(2-);zirconium
PubChem CID175724896
Molecular FormulaFeOZr
Molecular Weight163.07 g/mol
Exact Mass161.83
IUPAC Nameiron(2+);oxygen(2-);zirconium
SMILES[Fe+2].[O-2].[Zr]
InChIInChI=1S/Fe.O.Zr/q+2;-2;
InChIKeyNPLLLADUNACAGJ-UHFFFAOYSA-N
XLogP-0.12
TPSA28.50 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms3
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.07
LogP ≤ 5-0.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of iron(2+);oxygen(2-);zirconium?
The IUPAC name of iron(2+);oxygen(2-);zirconium (CID 175724896) is iron(2+);oxygen(2-);zirconium.
What is the SMILES notation for iron(2+);oxygen(2-);zirconium?
The canonical SMILES for iron(2+);oxygen(2-);zirconium is [Fe+2].[O-2].[Zr].
What is the InChIKey of iron(2+);oxygen(2-);zirconium?
The InChIKey is NPLLLADUNACAGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/Fe.O.Zr/q+2;-2;.
What are the key properties of iron(2+);oxygen(2-);zirconium?
iron(2+);oxygen(2-);zirconium has a molecular weight of 163.07 g/mol, XLogP of -0.12, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for iron(2+);oxygen(2-);zirconium is sourced from PubChem (CID 175724896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).