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Barium Hydride
CAS: 13477-09-3 | H2Ba
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
13477-09-3
Molecular Formula:
H2Ba
Molecular Mass:
139.34 g/mol
Names and Synonyms:
Barium Hydride
Barium hydride (BaH2)
Barium dihydride
Barium hydride
Identifiers:
SMILES:
[Ba].[H].[H]
InChI:
InChI=1S/Ba.2H
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 | 139.34 g/mol | CAS Common Chemistry |
| 139.34400000000002 g/mol | RDKit | |
| 139.920897264 g/mol | RDKit | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Barium_hydride | CAS Common Chemistry |
| Canonical SMILES | [BaH2] | CAS Common Chemistry |
| InChI | InChI=1S/Ba.2H | CAS Common Chemistry |
| InChI Key | InChIKey=MUBOSUMMMUSVEO-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Barium hydride (BaH2) | CAS Common Chemistry |
| Barium hydride | CAS Common Chemistry | |
| Heavy Atom Count | 1 | 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 | -0.15580000000000005 | RDKit |
| Molar Refractivity | 7.978 | RDKit |
