Molecule

ID:108366

General Information
Structure
MolImage
Molecular Formula
Al₂Ba₂O₅
Molecular Mass
408.614076
Exact Mass
409.74814436
Charge
0
InChI
InChI=1S/2Al.2Ba.5O/q2*+3;2*+2;5*-2
InChIKey
WIHSDLARTQXPRC-UHFFFAOYSA-N
Canonic Smiles
[O-2].[O-2].[O-2].[O-2].[O-2].[AlH3+3].[AlH3+3].[Ba+2].[Ba+2]
Isomeric Smiles
[O-2].[O-2].[O-2].[O-2].[O-2].[AlH3+3].[AlH3+3].[Ba+2].[Ba+2]
Calculated Properties
JChem
Acid pKa
15.7
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
-0.652
LogD (pH = 7.4)
-0.652
Log P
-0.652
Molar Refractivity
13.1149
Polarizability
1.8190874
Polar Surface Area
0.0
Rotatable Bonds
0
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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