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Lithium Nitride
CAS: 26134-62-3 | Li3N
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
26134-62-3
Molecular Formula:
Li3N
Molecular Weight:
34.83 g/mol
Names and Synonyms:
Lithium Nitride
Synonym
Lithium nitride (Li3N)
Synonym
Trilithium nitride (Li3N)
Synonym
Trilithium nitride
Synonym
Lithium nitride
Synonym
Identifiers:
SMILES:
[Li].[Li].[Li].[N]
InChI:
InChI=1S/3Li.N
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
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| Shift (ppm) | Multiplicity | Integration | Assignment |
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200 ppm
180
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| Shift (ppm) | DEPT | Assignment |
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Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
Physical Properties
| Property | Value | Source |
|---|---|---|
| molecular_mass | 34.83 g/mol | Legacy Database |
| wikipedia_url | https://en.wikipedia.org/wiki/Lithium_nitride None | Legacy Database |
| cas-canonical-smile | [Li]N([Li])[Li] None | Legacy Database |
| cas-inchi | InChI=1S/3Li.N None | Legacy Database |
| cas-inchi-key | InChIKey=IDBFBDSKYCUNPW-UHFFFAOYSA-N None | Legacy Database |
| cas-melting-point | 813 °C None | Legacy Database |
| cas-name | Lithium nitride None | Legacy Database |
| wikipedia-name | Lithium nitride None | Legacy Database |
| LogP | -1.6230000000000002 | RDKit |
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 34.83 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 35.05108765 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 4 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 0 count | RDKit |
| Hydrogen Bond Donors | 0 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 0 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 0 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 30.5 Ų | RDKit |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 19.396 | RDKit |