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Molecule
Sulfamic Acid, Cobalt(2+) Salt (2:1)
CAS: 14017-41-5 · H3CoNO3S
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 14017-41-5
- Molecular Formula
- H3CoNO3S
- Molecular Mass
- 156.03 g/mol
Identifiers
CAS Registry Number
14017-41-5
SMILES
NS(=O)(=O)O.[Co]
InChI Key
VWFLTHZUCYHIEC-UHFFFAOYSA-N
InChI
InChI=1S/Co.H3NO3S/c;1-5(2,3)4/h;(H3,1,2,3,4)
Names and Synonyms
- Sulfamic Acid, Cobalt(2+) Salt (2:1) Synonym
- Sulfamic acid, cobalt(2+) salt (2:1) Synonym
- Cobalt sulfamate Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 156.03 g/mol | CAS Common Chemistry |
| 156.028 g/mol | RDKit | |
| 158.037 g/mol | chempirical lib | |
| Canonical SMILES | [Co].O=S(=O)(O)N | CAS Common Chemistry |
| InChI | InChI=1S/Co.H3NO3S/c;1-5(2,3)4/h;(H3,1,2,3,4) | CAS Common Chemistry |
| InChI Key | InChIKey=VWFLTHZUCYHIEC-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Sulfamic acid, cobalt(2+) salt (2:1) | CAS Common Chemistry |
| Heavy Atom Count | 6 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 80.39 Ų | RDKit |
| LogP | -1.2545999999999995 | RDKit |
| -1.2546 | RDKit | |
| Molar Refractivity | 15.736 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 155.916558956 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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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 = 156.03 g/mol. Edit any field — others recompute live.
