barium(2+);tetrachloromethane;dichloride

CBaCl6 — CID 141230689

IUPACbarium(2+);tetrachloromethane;dichloride
SMILESClC(Cl)(Cl)Cl.[Ba+2].[Cl-].[Cl-]
InChIInChI=1S/CCl4.Ba.2ClH/c2-1(3,4)5;;;/h;;2*1H/q;+2;;/p-2
InChIKeyQBQRBOGDDHNIMC-UHFFFAOYSA-L
MW362.06 g/mol
LogP-3.82
Rot. Bonds

About barium(2+);tetrachloromethane;dichloride

barium(2+);tetrachloromethane;dichloride (PubChem CID 141230689) has the molecular formula CBaCl6 and a molecular weight of 362.06 g/mol. Its IUPAC name is barium(2+);tetrachloromethane;dichloride.

Molecular Properties

Compound Namebarium(2+);tetrachloromethane;dichloride
PubChem CID141230689
Molecular FormulaCBaCl6
Molecular Weight362.06 g/mol
Exact Mass359.72
IUPAC Namebarium(2+);tetrachloromethane;dichloride
SMILESClC(Cl)(Cl)Cl.[Ba+2].[Cl-].[Cl-]
InChIInChI=1S/CCl4.Ba.2ClH/c2-1(3,4)5;;;/h;;2*1H/q;+2;;/p-2
InChIKeyQBQRBOGDDHNIMC-UHFFFAOYSA-L
XLogP-3.82
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.06
LogP ≤ 5-3.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of barium(2+);tetrachloromethane;dichloride?
The IUPAC name of barium(2+);tetrachloromethane;dichloride (CID 141230689) is barium(2+);tetrachloromethane;dichloride.
What is the SMILES notation for barium(2+);tetrachloromethane;dichloride?
The canonical SMILES for barium(2+);tetrachloromethane;dichloride is ClC(Cl)(Cl)Cl.[Ba+2].[Cl-].[Cl-].
What is the InChIKey of barium(2+);tetrachloromethane;dichloride?
The InChIKey is QBQRBOGDDHNIMC-UHFFFAOYSA-L. The full InChI is InChI=1S/CCl4.Ba.2ClH/c2-1(3,4)5;;;/h;;2*1H/q;+2;;/p-2.
What are the key properties of barium(2+);tetrachloromethane;dichloride?
barium(2+);tetrachloromethane;dichloride has a molecular weight of 362.06 g/mol, XLogP of -3.82, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for barium(2+);tetrachloromethane;dichloride is sourced from PubChem (CID 141230689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).