zinc;barium(2+);oxygen(2-);iodide

BaIOZn+ — CID 160725364

IUPACzinc;barium(2+);oxygen(2-);iodide
SMILES[Ba+2].[I-].[O-2].[Zn+2]
InChIInChI=1S/Ba.HI.O.Zn/h;1H;;/q+2;;-2;+2/p-1
InChIKeyMHJWXVFJNREWFN-UHFFFAOYSA-M
MW345.62 g/mol
LogP-3.50
Rot. Bonds

About zinc;barium(2+);oxygen(2-);iodide

zinc;barium(2+);oxygen(2-);iodide (PubChem CID 160725364) has the molecular formula BaIOZn+ and a molecular weight of 345.62 g/mol. Its IUPAC name is zinc;barium(2+);oxygen(2-);iodide.

Molecular Properties

Compound Namezinc;barium(2+);oxygen(2-);iodide
PubChem CID160725364
Molecular FormulaBaIOZn+
Molecular Weight345.62 g/mol
Exact Mass344.73
IUPAC Namezinc;barium(2+);oxygen(2-);iodide
SMILES[Ba+2].[I-].[O-2].[Zn+2]
InChIInChI=1S/Ba.HI.O.Zn/h;1H;;/q+2;;-2;+2/p-1
InChIKeyMHJWXVFJNREWFN-UHFFFAOYSA-M
XLogP-3.50
TPSA28.50 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.62
LogP ≤ 5-3.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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bis(barium(2+));pentakis(oxygen(2-));bis(scandium(3+))
CID 6453061
barium(2+);molybdenum(4+);tris(oxygen(2-))
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tetrakis(antimony(3+));pentakis(oxygen(2-));diiodide
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CID 139064321
zinc;cadmium(2+);tetraiodide
CID 157302007
dizinc;bis(lanthanum(3+));pentakis(oxygen(2-))
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CID 159738896
iodanium;zinc;triiodide
CID 172845539

Frequently Asked Questions

What is the IUPAC name of zinc;barium(2+);oxygen(2-);iodide?
The IUPAC name of zinc;barium(2+);oxygen(2-);iodide (CID 160725364) is zinc;barium(2+);oxygen(2-);iodide.
What is the SMILES notation for zinc;barium(2+);oxygen(2-);iodide?
The canonical SMILES for zinc;barium(2+);oxygen(2-);iodide is [Ba+2].[I-].[O-2].[Zn+2].
What is the InChIKey of zinc;barium(2+);oxygen(2-);iodide?
The InChIKey is MHJWXVFJNREWFN-UHFFFAOYSA-M. The full InChI is InChI=1S/Ba.HI.O.Zn/h;1H;;/q+2;;-2;+2/p-1.
What are the key properties of zinc;barium(2+);oxygen(2-);iodide?
zinc;barium(2+);oxygen(2-);iodide has a molecular weight of 345.62 g/mol, XLogP of -3.50, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for zinc;barium(2+);oxygen(2-);iodide is sourced from PubChem (CID 160725364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).