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Molecule
Cerium(Iii) Fluoride
CAS: 7758-88-5 · CeF3
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 7758-88-5
- Molecular Formula
- CeF3
- Molecular Mass
- 197.11 g/mol
Identifiers
CAS Registry Number
7758-88-5
SMILES
[Ce+3].[F-].[F-].[F-]
InChI Key
QCCDYNYSHILRDG-UHFFFAOYSA-K
InChI
InChI=1S/Ce.3FH/h;3*1H/q+3;;;/p-3
Names and Synonyms
- Cerium(Iii) Fluoride Synonym
- Cerium fluoride (CeF3) Synonym
- Cerium trifluoride Synonym
- Cerous fluoride Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 197.11 g/mol | CAS Common Chemistry |
| 197.10999999999999 g/mol | RDKit | |
| 203.158 g/mol | chempirical lib | |
| Density | 6.13 g/cm³ | CAS Common Chemistry |
| 6.126 g/cm3 | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Cerium(III)_fluoride | CAS Common Chemistry |
| Canonical SMILES | F[Ce](F)F | CAS Common Chemistry |
| InChI | InChI=1S/Ce.3FH/h;3*1H/q+3;;;/p-3 | CAS Common Chemistry |
| InChI Key | InChIKey=QCCDYNYSHILRDG-UHFFFAOYSA-K | CAS Common Chemistry |
| Melting Point | 1459 °C | CAS Common Chemistry |
| Name | Cerium trifluoride | 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 | 196.90064836 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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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 = 197.11 g/mol; density = 6.130 g/mL. Edit any field — others recompute live.
