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Molecule
Gadolinium(Iii) Chloride
CAS: 10138-52-0 · Cl3Gd
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 10138-52-0
- Molecular Formula
- Cl3Gd
- Molecular Mass
- 263.61 g/mol
Identifiers
CAS Registry Number
10138-52-0
SMILES
[Cl-].[Cl-].[Cl-].[Gd+3]
InChI Key
MEANOSLIBWSCIT-UHFFFAOYSA-K
InChI
InChI=1S/3ClH.Gd/h3*1H;/q;;;+3/p-3
Names and Synonyms
- Gadolinium(Iii) Chloride Synonym
- Gadolinium chloride (GdCl3) Synonym
- Gadolinium trichloride Synonym
- Gadolinium chloride Synonym
- Gadolinium(III) chloride Synonym
- NSC 174322 Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 263.61 g/mol | CAS Common Chemistry |
| 263.60900000000004 g/mol | RDKit | |
| 263.609 g/mol | RDKit | |
| 269.648 g/mol | chempirical lib | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Gadolinium(III)_chloride | CAS Common Chemistry |
| Canonical SMILES | Cl[Gd](Cl)Cl | CAS Common Chemistry |
| InChI | InChI=1S/3ClH.Gd/h3*1H;/q;;;+3/p-3 | CAS Common Chemistry |
| InChI Key | InChIKey=MEANOSLIBWSCIT-UHFFFAOYSA-K | CAS Common Chemistry |
| Melting Point | 609 °C | CAS Common Chemistry |
| Name | Gadolinium chloride | CAS Common Chemistry |
| Heavy Atom Count | 4 | 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 | -8.988 | RDKit |
| Molar Refractivity | 0.0 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 262.83066193999997 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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1
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| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
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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.
External Resources
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MW = 263.61 g/mol. Edit any field — others recompute live.
