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Molecule
Molybdenum(V) Chloride
CAS: 10241-05-1 · Cl5Mo
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 10241-05-1
- Molecular Formula
- Cl5Mo
- Molecular Mass
- 273.21 g/mol
Identifiers
CAS Registry Number
10241-05-1
SMILES
[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Mo+5]
InChI Key
GICWIDZXWJGTCI-UHFFFAOYSA-I
InChI
InChI=1S/5ClH.Mo/h5*1H;/q;;;;;+5/p-5
Names and Synonyms
- Molybdenum(V) Chloride Common Name
- Molybdenum chloride (MoCl5) Synonym
- Molybdenum pentachloride Synonym
- Pentachloromolybdenum Synonym
- Molybdenum(V) chloride Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 273.21 g/mol | CAS Common Chemistry |
| 273.20500000000004 g/mol | RDKit | |
| 273.205 g/mol | RDKit | |
| 280.256 g/mol | chempirical lib | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Molybdenum(V)_chloride | CAS Common Chemistry |
| Boiling Point | 352 °C | CAS Common Chemistry |
| Canonical SMILES | Cl[Mo](Cl)(Cl)(Cl)Cl | CAS Common Chemistry |
| InChI | InChI=1S/5ClH.Mo/h5*1H;/q;;;;;+5/p-5 | CAS Common Chemistry |
| InChI Key | InChIKey=GICWIDZXWJGTCI-UHFFFAOYSA-I | CAS Common Chemistry |
| Melting Point | 194 °C | CAS Common Chemistry |
| Name | Molybdenum pentachloride | CAS Common Chemistry |
| Heavy Atom Count | 6 | 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 | -14.9825 | RDKit |
| Molar Refractivity | 0.0 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 272.7496716 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
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.
External Resources
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MW = 273.21 g/mol. Edit any field — others recompute live.