barium(2+);cerium;hydride;lanthanum;zirconium

H2BaCeLaZr — CID 174729008

IUPACbarium(2+);cerium;hydride;lanthanum;zirconium
SMILES[Ba+2].[Ce].[H-].[H-].[La].[Zr]
InChIInChI=1S/Ba.Ce.La.Zr.2H/q+2;;;;2*-1
InChIKeyNVZROKQAIJYADK-UHFFFAOYSA-N
MW509.59 g/mol
LogP-0.16
Rot. Bonds

About barium(2+);cerium;hydride;lanthanum;zirconium

barium(2+);cerium;hydride;lanthanum;zirconium (PubChem CID 174729008) has the molecular formula H2BaCeLaZr and a molecular weight of 509.59 g/mol. Its IUPAC name is barium(2+);cerium;hydride;lanthanum;zirconium.

Molecular Properties

Compound Namebarium(2+);cerium;hydride;lanthanum;zirconium
PubChem CID174729008
Molecular FormulaH2BaCeLaZr
Molecular Weight509.59 g/mol
Exact Mass508.64
IUPAC Namebarium(2+);cerium;hydride;lanthanum;zirconium
SMILES[Ba+2].[Ce].[H-].[H-].[La].[Zr]
InChIInChI=1S/Ba.Ce.La.Zr.2H/q+2;;;;2*-1
InChIKeyNVZROKQAIJYADK-UHFFFAOYSA-N
XLogP-0.16
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500509.59
LogP ≤ 5-0.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of barium(2+);cerium;hydride;lanthanum;zirconium?
The IUPAC name of barium(2+);cerium;hydride;lanthanum;zirconium (CID 174729008) is barium(2+);cerium;hydride;lanthanum;zirconium.
What is the SMILES notation for barium(2+);cerium;hydride;lanthanum;zirconium?
The canonical SMILES for barium(2+);cerium;hydride;lanthanum;zirconium is [Ba+2].[Ce].[H-].[H-].[La].[Zr].
What is the InChIKey of barium(2+);cerium;hydride;lanthanum;zirconium?
The InChIKey is NVZROKQAIJYADK-UHFFFAOYSA-N. The full InChI is InChI=1S/Ba.Ce.La.Zr.2H/q+2;;;;2*-1.
What are the key properties of barium(2+);cerium;hydride;lanthanum;zirconium?
barium(2+);cerium;hydride;lanthanum;zirconium has a molecular weight of 509.59 g/mol, XLogP of -0.16, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for barium(2+);cerium;hydride;lanthanum;zirconium is sourced from PubChem (CID 174729008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).