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Tantalum Nitride
CAS: 12033-62-4 | NTa
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
12033-62-4
Molecular Formula:
NTa
Molecular Mass:
194.96 g/mol
Names and Synonyms:
Tantalum Nitride
Tantalum nitride (TaN)
Tantalum mononitride
Tantalum nitride
Tantalum nitride Ta0.5N0.5
Identifiers:
SMILES:
[N].[Ta]
InChI:
InChI=1S/N.Ta
Key Properties
Density
14.60 g/cm³
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 | 194.96 g/mol | CAS Common Chemistry |
| 194.955 g/mol | RDKit | |
| 194.9510698 g/mol | RDKit | |
| Density | 14.60 g/cm³ | CAS Common Chemistry |
| 14.6 g/cm3 | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Tantalum_nitride | CAS Common Chemistry |
| Canonical SMILES | N#[Ta] | CAS Common Chemistry |
| InChI | InChI=1S/N.Ta | CAS Common Chemistry |
| InChI Key | InChIKey=MZLGASXMSKOWSE-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Tantalum nitride (TaN) | CAS Common Chemistry |
| Tantalum nitride | CAS Common Chemistry | |
| Heavy Atom Count | 2 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 30.5 Ų | RDKit |
| LogP | -0.48310000000000003 | RDKit |
| Molar Refractivity | 2.134 | RDKit |
