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Molecule
Ytterbium(Iii) Bromide
CAS: 13759-89-2 · Br3Yb
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 13759-89-2
- Molecular Formula
- Br3Yb
- Molecular Mass
- 412.75 g/mol
Identifiers
CAS Registry Number
13759-89-2
SMILES
[Br-].[Br-].[Br-].[Yb+3]
InChI Key
QNLXXQBCQYDKHD-UHFFFAOYSA-K
InChI
InChI=1S/3BrH.Yb/h3*1H;/q;;;+3/p-3
Names and Synonyms
- Ytterbium(Iii) Bromide Synonym
- Ytterbium bromide (YbBr3) Synonym
- Ytterbium tribromide Synonym
- Ytterbium bromide Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 412.75 g/mol | CAS Common Chemistry |
| 412.75199999999995 g/mol | RDKit | |
| 412.752 g/mol | RDKit | |
| 417.797 g/mol | chempirical lib | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Ytterbium(III)_bromide | CAS Common Chemistry |
| Canonical SMILES | Br[Yb](Br)Br | CAS Common Chemistry |
| InChI | InChI=1S/3BrH.Yb/h3*1H;/q;;;+3/p-3 | CAS Common Chemistry |
| InChI Key | InChIKey=QNLXXQBCQYDKHD-UHFFFAOYSA-K | CAS Common Chemistry |
| Name | Ytterbium bromide (YbBr3) | 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 | 410.6938734 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
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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 = 412.75 g/mol. Edit any field — others recompute live.
