nonakis(oxygen(2-));bis(tantalum(5+));bis(zirconium(4+))

O9Ta2Zr2 — CID 18629950

IUPACnonakis(oxygen(2-));bis(tantalum(5+));bis(zirconium(4+))
SMILES[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Ta+5].[Ta+5].[Zr+4].[Zr+4]
InChIInChI=1S/9O.2Ta.2Zr/q9*-2;2*+5;2*+4
InChIKeyVSCVHGCFXBIVAO-UHFFFAOYSA-N
MW688.34 g/mol
LogP-1.08
Rot. Bonds

About nonakis(oxygen(2-));bis(tantalum(5+));bis(zirconium(4+))

nonakis(oxygen(2-));bis(tantalum(5+));bis(zirconium(4+)) (PubChem CID 18629950) has the molecular formula O9Ta2Zr2 and a molecular weight of 688.34 g/mol. Its IUPAC name is nonakis(oxygen(2-));bis(tantalum(5+));bis(zirconium(4+)).

Molecular Properties

Compound Namenonakis(oxygen(2-));bis(tantalum(5+));bis(zirconium(4+))
PubChem CID18629950
Molecular FormulaO9Ta2Zr2
Molecular Weight688.34 g/mol
Exact Mass685.66
IUPAC Namenonakis(oxygen(2-));bis(tantalum(5+));bis(zirconium(4+))
SMILES[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Ta+5].[Ta+5].[Zr+4].[Zr+4]
InChIInChI=1S/9O.2Ta.2Zr/q9*-2;2*+5;2*+4
InChIKeyVSCVHGCFXBIVAO-UHFFFAOYSA-N
XLogP-1.08
TPSA256.50 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500688.34
LogP ≤ 5-1.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of nonakis(oxygen(2-));bis(tantalum(5+));bis(zirconium(4+))?
The IUPAC name of nonakis(oxygen(2-));bis(tantalum(5+));bis(zirconium(4+)) (CID 18629950) is nonakis(oxygen(2-));bis(tantalum(5+));bis(zirconium(4+)).
What is the SMILES notation for nonakis(oxygen(2-));bis(tantalum(5+));bis(zirconium(4+))?
The canonical SMILES for nonakis(oxygen(2-));bis(tantalum(5+));bis(zirconium(4+)) is [O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Ta+5].[Ta+5].[Zr+4].[Zr+4].
What is the InChIKey of nonakis(oxygen(2-));bis(tantalum(5+));bis(zirconium(4+))?
The InChIKey is VSCVHGCFXBIVAO-UHFFFAOYSA-N. The full InChI is InChI=1S/9O.2Ta.2Zr/q9*-2;2*+5;2*+4.
What are the key properties of nonakis(oxygen(2-));bis(tantalum(5+));bis(zirconium(4+))?
nonakis(oxygen(2-));bis(tantalum(5+));bis(zirconium(4+)) has a molecular weight of 688.34 g/mol, XLogP of -1.08, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for nonakis(oxygen(2-));bis(tantalum(5+));bis(zirconium(4+)) is sourced from PubChem (CID 18629950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).