barium(2+);dihydroxy(dioxo)chromium;hydride;zinc

H4BaCrO4Zn — CID 173175751

IUPACbarium(2+);dihydroxy(dioxo)chromium;hydride;zinc
SMILESO=[Cr](=O)(O)O.[Ba+2].[H-].[H-].[Zn]
InChIInChI=1S/Ba.Cr.2H2O.2O.Zn.2H/h;;2*1H2;;;;;/q2*+2;;;;;;2*-1/p-2
InChIKeyVWVHYTKCAYNBFZ-UHFFFAOYSA-L
MW322.74 g/mol
LogP-1.51
Rot. Bonds

About barium(2+);dihydroxy(dioxo)chromium;hydride;zinc

barium(2+);dihydroxy(dioxo)chromium;hydride;zinc (PubChem CID 173175751) has the molecular formula H4BaCrO4Zn and a molecular weight of 322.74 g/mol. Its IUPAC name is barium(2+);dihydroxy(dioxo)chromium;hydride;zinc.

Molecular Properties

Compound Namebarium(2+);dihydroxy(dioxo)chromium;hydride;zinc
PubChem CID173175751
Molecular FormulaH4BaCrO4Zn
Molecular Weight322.74 g/mol
Exact Mass321.79
IUPAC Namebarium(2+);dihydroxy(dioxo)chromium;hydride;zinc
SMILESO=[Cr](=O)(O)O.[Ba+2].[H-].[H-].[Zn]
InChIInChI=1S/Ba.Cr.2H2O.2O.Zn.2H/h;;2*1H2;;;;;/q2*+2;;;;;;2*-1/p-2
InChIKeyVWVHYTKCAYNBFZ-UHFFFAOYSA-L
XLogP-1.51
TPSA74.60 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.74
LogP ≤ 5-1.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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 barium(2+);dihydroxy(dioxo)chromium;hydride;zinc?
The IUPAC name of barium(2+);dihydroxy(dioxo)chromium;hydride;zinc (CID 173175751) is barium(2+);dihydroxy(dioxo)chromium;hydride;zinc.
What is the SMILES notation for barium(2+);dihydroxy(dioxo)chromium;hydride;zinc?
The canonical SMILES for barium(2+);dihydroxy(dioxo)chromium;hydride;zinc is O=[Cr](=O)(O)O.[Ba+2].[H-].[H-].[Zn].
What is the InChIKey of barium(2+);dihydroxy(dioxo)chromium;hydride;zinc?
The InChIKey is VWVHYTKCAYNBFZ-UHFFFAOYSA-L. The full InChI is InChI=1S/Ba.Cr.2H2O.2O.Zn.2H/h;;2*1H2;;;;;/q2*+2;;;;;;2*-1/p-2.
What are the key properties of barium(2+);dihydroxy(dioxo)chromium;hydride;zinc?
barium(2+);dihydroxy(dioxo)chromium;hydride;zinc has a molecular weight of 322.74 g/mol, XLogP of -1.51, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for barium(2+);dihydroxy(dioxo)chromium;hydride;zinc is sourced from PubChem (CID 173175751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).