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Molecule
Sulfuric Acid, Ytterbium(3+) Salt (3:2), Octahydrate
CAS: 10034-98-7 · H6O6SYb
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 10034-98-7
- Molecular Formula
- H6O6SYb
- Molecular Mass
- 307.15 g/mol
Identifiers
CAS Registry Number
10034-98-7
SMILES
O.O.O=S(=O)(O)O.[Yb]
InChI Key
RRFQEMVPGYAMIC-UHFFFAOYSA-N
InChI
InChI=1S/H2O4S.2H2O.Yb/c1-5(2,3)4;;;/h(H2,1,2,3,4);2*1H2;
Names and Synonyms
- Sulfuric Acid, Ytterbium(3+) Salt (3:2), Octahydrate Systematic Name
- Sulfuric acid, ytterbium(3+) salt (3:2), octahydrate Synonym
- Ytterbium sulfate, octahydrate Synonym
- Ytterbium sulfate (Yb2(SO4)3) octahydrate Synonym
- Ytterbium sulfate hydrate (Yb2(SO4)3.8H2O) Synonym
- Diytterbium trisulfate octahydrate Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 307.15 g/mol | CAS Common Chemistry |
| 307.927371012 g/mol | RDKit | |
| 307.149 g/mol | RDKit | |
| 309.163 g/mol | chempirical lib | |
| Canonical SMILES | [Yb].O=S(=O)(O)O.O | CAS Common Chemistry |
| InChI | InChI=1S/H2O4S.2H2O.Yb/c1-5(2,3)4;;;/h(H2,1,2,3,4);2*1H2; | CAS Common Chemistry |
| InChI Key | InChIKey=RRFQEMVPGYAMIC-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Sulfuric acid, ytterbium(3+) salt (3:2), octahydrate | CAS Common Chemistry |
| Heavy Atom Count | 8 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 137.6 Ų | RDKit |
| 125.06 Ų | chempirical lib | |
| LogP | -2.3022 | RDKit |
| Molar Refractivity | 21.404999999999998 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 307.149 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
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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 = 307.15 g/mol. Edit any field — others recompute live.
