Molecule

ID:1779

General Information

Structure

MolImage

Molecular Formula

Fe₂N₃O

Molecular Mass

169.7095

Exact Mass

169.87401164

Charge

0

InChI

InChI=1S/2Fe.N3.O/c;;1-3-2;/q;+1;-1;

InChIKey

GTUZFHRZTDZJHZ-UHFFFAOYSA-N

Canonic Smiles

[N-]=[N+]=N[Fe]O[Fe]

Isomeric Smiles

[Fe]O[Fe]N=[N+]=[N-]

Calculated Properties

JChem

Acid pKa

5.430935

H Acceptors

3

H Donor

0

LogD (pH = 5.5)

1.762001

LogD (pH = 7.4)

1.7339842

Log P

1.7934

Molar Refractivity

12.2215

Polarizability

10.109008

Polar Surface Area

38.66

Rotatable Bonds

2

Lipinski's Rule of Five

true

Data Source

Names and Identifiers

Registration numbers

Properties

No Data Available

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Related Proteins

No Data Available

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Molecular Spectra

No Data Available

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Molecule Details

References

Bioactivity