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Aluminium Selenide
CAS: 1302-82-5 | AlSe
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
1302-82-5
Molecular Formula:
AlSe
Molecular Weight:
105.942 g/mol
Names and Synonyms:
Aluminium Selenide
Aluminum selenide (Al2Se3)
Aluminum selenide
Dialuminum triselenide
Aluminum sesquiselenide
Identifiers:
SMILES:
[Al].[Se]
InChI:
InChI=1S/Al.Se
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
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5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| 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
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 105.942 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 106.89805993 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 2 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 | 0.0 Ų | RDKit |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | -0.7616 | RDKit |
| molecular_mass | 105.94 g/mol | Legacy Database |
| wikipedia_url | https://en.wikipedia.org/wiki/Aluminium_selenide None | Legacy Database |
| cas-canonical-smile | [Al].[Se] None | Legacy Database |
| cas-inchi | InChI=1S/Al.Se None | Legacy Database |
| cas-inchi-key | InChIKey=AINNHYSCPOKHAO-UHFFFAOYSA-N None | Legacy Database |
| cas-name | Aluminum selenide (Al2Se3) None | Legacy Database |
| wikipedia-name | Aluminium selenide None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 11.508 | RDKit |
