Molecule

ID:109369

General Information
Structure
Molecular Formula
Ca₃N₂
Molecular Mass
148.2474
Exact Mass
147.89392095
Charge
0
InChI
InChI=1S/3Ca.2N/q;;+2;2*-1
InChIKey
XCNGEWCFFFJZJT-UHFFFAOYSA-N
Canonic Smiles
[Ca]=[N-].[Ca]=[N-].[Ca+2]
Isomeric Smiles
[Ca+2].[N-]=[Ca].[N-]=[Ca]
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
-1.8840458
LogD (pH = 7.4)
-0.7553018
Log P
-0.6799
Molar Refractivity
1.4429
Polarizability
3.7081494
Polar Surface Area
17.07
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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