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Cadmium Titanium Oxide (Cdtio3)
CAS: 12014-14-1 | CdOTi
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
12014-14-1
Molecular Formula:
CdOTi
Molecular Mass:
176.28 g/mol
Names and Synonyms:
Cadmium Titanium Oxide (Cdtio3)
Cadmium titanium oxide (CdTiO3)
Cadmium titanate(IV) (CdTiO3)
Cadmium titanate (CdTiO3)
Cadmium titanium trioxide
Identifiers:
SMILES:
[Cd].[O].[Ti]
InChI:
InChI=1S/Cd.O.Ti
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 | 176.28 g/mol | CAS Common Chemistry |
| 176.278 g/mol | RDKit | |
| 177.84621942 g/mol | RDKit | |
| Canonical SMILES | [O].[Ti].[Cd] | CAS Common Chemistry |
| InChI | InChI=1S/Cd.O.Ti | CAS Common Chemistry |
| InChI Key | InChIKey=WYNLPLCPFSSHDV-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Cadmium titanium oxide (CdTiO3) | CAS Common Chemistry |
| Heavy Atom Count | 3 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 28.5 Ų | RDKit |
| LogP | -0.12380000000000001 | RDKit |
| Molar Refractivity | 0.6865 | RDKit |
