Molecule

ID:135762

General Information
Structure
MolImage
Molecular Formula
Cr₂NiO₄
Molecular Mass
226.6832
Exact Mass
225.79601638
Charge
0
InChI
InChI=1S/2Cr.Ni.4O/q;;+2;;;2*-1
InChIKey
SMFKXCAVXCXXDR-UHFFFAOYSA-N
Canonic Smiles
[O-][Cr]=O.[O-][Cr]=O.[Ni+2]
Isomeric Smiles
[O-][Cr]=O.[O-][Cr]=O.[Ni+2]
Calculated Properties
JChem
Acid pKa
3.0
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
-3.4039774
LogD (pH = 7.4)
-3.598255
Log P
-1.3376
Molar Refractivity
2.8858
Polarizability
4.6269927
Polar Surface Area
40.13
Rotatable Bonds
0
Lipinski's Rule of Five
true
Data Source
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Names and Identifiers
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Registration numbers
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Properties
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Related Proteins
No Data Available
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Molecular Spectra
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Molecule Details
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References
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Bioactivity
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