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Caesium Carbonate
CAS: 534-17-8 | CH2Cs2O3
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
534-17-8
Molecular Formula:
CH2Cs2O3
Molecular Mass:
327.83 g/mol
Names and Synonyms:
Caesium Carbonate
Carbonic acid, cesium salt (1:2)
Carbonic acid, dicesium salt
Cesium carbonate (Cs2CO3)
Dicesium carbonate
Cesium carbonate
Caesium carbonate
Identifiers:
SMILES:
O=C(O)O.[Cs].[Cs]
InChI:
InChI=1S/CH2O3.2Cs/c2-1(3)4;;/h(H2,2,3,4);;
Key Properties
Melting Point
794 °C
CAS Common Chemistry
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
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.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 327.83 g/mol | CAS Common Chemistry |
| 327.834 g/mol | RDKit | |
| 327.811297724 g/mol | RDKit | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Caesium_carbonate | CAS Common Chemistry |
| Canonical SMILES | [Cs].O=C(O)O | CAS Common Chemistry |
| InChI | InChI=1S/CH2O3.2Cs/c2-1(3)4;;/h(H2,2,3,4);; | CAS Common Chemistry |
| InChI Key | InChIKey=UJEVSBFGTVHBGT-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 794 °C | CAS Common Chemistry |
| Name | Cesium carbonate | CAS Common Chemistry |
| Caesium carbonate | CAS Common Chemistry | |
| Heavy Atom Count | 6 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 57.53 Ų | RDKit |
| LogP | -0.5391999999999999 | RDKit |
| Molar Refractivity | 22.1616 | RDKit |
