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Molecule
Chromium(Ii) Selenide
CAS: 12053-13-3 · CrSe
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 12053-13-3
- Molecular Formula
- CrSe
- Molecular Mass
- 130.96 g/mol
Identifiers
CAS Registry Number
12053-13-3
SMILES
[Cr].[Se]
InChI Key
UVZCKRKEVWSRGT-UHFFFAOYSA-N
InChI
InChI=1S/Cr.Se
Names and Synonyms
- Chromium(Ii) Selenide Synonym
- Chromium selenide (CrSe) Synonym
- Chromium monoselenide Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 130.96 g/mol | CAS Common Chemistry |
| 131.8570288 g/mol | RDKit | |
| 130.956 g/mol | RDKit | |
| 134.988 g/mol | chempirical lib | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Chromium(II)_selenide | CAS Common Chemistry |
| Canonical SMILES | [Cr]=[Se] | CAS Common Chemistry |
| InChI | InChI=1S/Cr.Se | CAS Common Chemistry |
| InChI Key | InChIKey=UVZCKRKEVWSRGT-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Chromium selenide (CrSe) | 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 | 0.0 Ų | RDKit |
| LogP | -0.38330000000000003 | RDKit |
| -0.3833 | RDKit | |
| Molar Refractivity | 5.754 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 130.956 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
9
8
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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.
External Resources
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MW = 130.96 g/mol. Edit any field — others recompute live.
