Back to Search
Caesium Cyanide
CAS: 21159-32-0 | CCsN
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
21159-32-0
Molecular Formula:
CCsN
Molecular Mass:
158.92 g/mol
Names and Synonyms:
Caesium Cyanide
Cesium cyanide (Cs(CN))
Cesium cyanide
Identifiers:
SMILES:
[C]#N.[Cs]
InChI:
InChI=1S/CN.Cs/c1-2;
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 | 158.92 g/mol | CAS Common Chemistry |
| 158.923 g/mol | RDKit | |
| 158.9085259 g/mol | RDKit | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Caesium_cyanide | CAS Common Chemistry |
| Canonical SMILES | N#C[Cs] | CAS Common Chemistry |
| InChI | InChI=1S/CN.Cs/c1-2; | CAS Common Chemistry |
| InChI Key | InChIKey=URDDSQFRWKZOQO-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Cesium cyanide (Cs(CN)) | CAS Common Chemistry |
| Caesium cyanide | CAS Common Chemistry | |
| Heavy Atom Count | 3 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 23.79 Ų | RDKit |
| LogP | -0.28443 | RDKit |
| Molar Refractivity | 10.722 | RDKit |
