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25658-42-8 molecular structure
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λ3-zirconium(3+) ion azanetriide

ChemBase ID: 302859
Molecular Formular: NZr
Molecular Mass: 105.2307
Monoisotopic Mass: 103.90777801
SMILES and InChIs

SMILES:
[NH3-3].[Zr+3]
Canonical SMILES:
[NH3-3].[Zr+3]
InChI:
InChI=1S/N.Zr/q-3;+3
InChIKey:
VZINRLBUWBGASR-UHFFFAOYSA-N

Cite this record

CBID:302859 http://www.chembase.cn/molecule-302859.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
λ3-zirconium(3+) ion azanetriide
IUPAC Traditional name
λ3-zirconium(3+) ion azanetriide
Synonyms
Zirconium nitride
氮化锆
CAS Number
25658-42-8
EC Number
247-166-2
MDL Number
MFCD00049642

DATA SOURCES

DATA SOURCES

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Data Source Data ID
Alfa Aesar 12138 external link Add to cart
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Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -3.7525723  LogD (pH = 7.4) -2.4393091 
Log P -0.978  Molar Refractivity 13.1149 cm3
Polarizability 1.1767 Å3 Polar Surface Area 0.0 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Apperance
-325 Mesh Powder expand Show data source
Melting Point
2980°C expand Show data source
Density
7.09 expand Show data source
European Hazard Symbols
Flammable Flammable (F) expand Show data source
Irritant Irritant (Xi) expand Show data source
UN Number
UN3178 expand Show data source
Hazard Class
4.1 expand Show data source
Packing Group
III expand Show data source
Risk Statements
11-36/37/38 expand Show data source
Safety Statements
26-37 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS02 expand Show data source
GHS07 expand Show data source
GHS Hazard statements
H228-H315-H319-H335 expand Show data source
GHS Precautionary statements
P210-P241-P305+P351+P338-P302+P352-P405-P501A expand Show data source
Purity
99.5% (metals basis excluding Hf), Hf <3% expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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