Molecule

ID:108019

General Information

Structure

MolImage

Molecular Formula

C₆FeN₆Pb₂

Molecular Mass

626.3494

Exact Mass

627.90668553

Charge

0

InChI

InChI=1S/6CN.Fe.2Pb/c6*1-2;;;/q;;;;;;-4;2*+2

InChIKey

KHNINSWJLIUMGY-UHFFFAOYSA-N

Canonic Smiles

N#C[Fe-4](C#N)(C#N)(C#N)(C#N)C#N.[Pb+2].[Pb+2]

Isomeric Smiles

[Pb+2].[Pb+2].N#C[Fe-4](C#N)(C#N)(C#N)(C#N)C#N

Calculated Properties

JChem

H Acceptors

6

H Donor

0

LogD (pH = 5.5)

-0.2594

LogD (pH = 7.4)

-0.2594

Log P

-0.2594

Molar Refractivity

39.9336

Polarizability

15.723072

Polar Surface Area

142.74

Rotatable Bonds

0

Lipinski's Rule of Five

false

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