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Iridium Tetrachloride
CAS: 10025-97-5 | Cl4Ir
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
10025-97-5
Molecular Formula:
Cl4Ir
Molecular Mass:
334.03 g/mol
Names and Synonyms:
Iridium Tetrachloride
Iridium chloride (IrCl4)
Iridium tetrachloride
Iridium(IV) chloride
Identifiers:
SMILES:
[Cl-].[Cl-].[Cl-].[Cl-].[Ir+4]
InChI:
InChI=1S/4ClH.Ir/h4*1H;/q;;;;+4/p-4
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 | 334.03 g/mol | CAS Common Chemistry |
| 334.029 g/mol | RDKit | |
| 332.83833712 g/mol | RDKit | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Iridium_tetrachloride | CAS Common Chemistry |
| Canonical SMILES | Cl[Ir](Cl)(Cl)Cl | CAS Common Chemistry |
| InChI | InChI=1S/4ClH.Ir/h4*1H;/q;;;;+4/p-4 | CAS Common Chemistry |
| InChI Key | InChIKey=CALMYRPSSNRCFD-UHFFFAOYSA-J | CAS Common Chemistry |
| Name | Iridium tetrachloride | CAS Common Chemistry |
| Heavy Atom Count | 5 | 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 | -11.9865 | RDKit |
| Molar Refractivity | 0.0 | RDKit |
