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Tungsten Hexachloride
CAS: 13283-01-7 | Cl6W
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
13283-01-7
Molecular Formula:
Cl6W
Molecular Mass:
396.56 g/mol
Names and Synonyms:
Tungsten Hexachloride
Tungsten chloride (WCl6), (OC-6-11)-
Tungsten chloride (WCl6)
Tungsten hexachloride
Hexachlorotungsten
Wolfram hexachloride
Hexachlorotungsten (Cl6W)
Tungsten(VI) chloride
Tungsten chloride
Identifiers:
SMILES:
[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[W+6]
InChI:
InChI=1S/6ClH.W/h6*1H;/q;;;;;;+6/p-6
Key Properties
Boiling Point
336.5 °C
CAS Common Chemistry
Melting Point
283 °C
CAS Common Chemistry
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
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 |
|---|
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
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 396.56 g/mol | CAS Common Chemistry |
| 396.558 g/mol | RDKit | |
| 393.76404728 g/mol | RDKit | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Tungsten_hexachloride | CAS Common Chemistry |
| Boiling Point | 336.5 °C | CAS Common Chemistry |
| Canonical SMILES | Cl[W](Cl)(Cl)(Cl)(Cl)Cl | CAS Common Chemistry |
| InChI | InChI=1S/6ClH.W/h6*1H;/q;;;;;;+6/p-6 | CAS Common Chemistry |
| InChI Key | InChIKey=KPGXUAIFQMJJFB-UHFFFAOYSA-H | CAS Common Chemistry |
| Melting Point | 283 °C | CAS Common Chemistry |
| Name | Tungsten hexachloride | CAS Common Chemistry |
| Heavy Atom Count | 7 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 0.0 Ų | RDKit |
| LogP | -17.9785 | RDKit |
| Molar Refractivity | 0.0 | RDKit |
