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Molecule
Nickel Sulfamate
CAS: 13770-89-3 · H3NNiO3S
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 13770-89-3
- Molecular Formula
- H3NNiO3S
- Molecular Mass
- 155.79 g/mol
Identifiers
CAS Registry Number
13770-89-3
SMILES
NS(=O)(=O)O.[Ni]
InChI Key
DITXJPASYXFQAS-UHFFFAOYSA-N
InChI
InChI=1S/H3NO3S.Ni/c1-5(2,3)4;/h(H3,1,2,3,4);
Names and Synonyms
- Nickel Sulfamate Common Name
- Sulfamic acid, nickel(2+) salt (2:1) Synonym
- Nickel sulfamate Synonym
- Nickel sulfamate (Ni(SO3NH2)2) Synonym
- Nickel sulfamate (Ni(H2NSO3)2) Synonym
- Aeronikl 250 Synonym
- Aeronikl 400 Synonym
- Aeronikl 575 Synonym
- Melbright EF 2201 Synonym
- NS 169 Synonym
- Nickel aminosulfonate Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 155.79 g/mol | CAS Common Chemistry |
| 155.78799999999998 g/mol | RDKit | |
| 155.788 g/mol | RDKit | |
| 157.797 g/mol | chempirical lib | |
| Canonical SMILES | [Ni].O=S(=O)(O)N | CAS Common Chemistry |
| InChI | InChI=1S/H3NO3S.Ni/c1-5(2,3)4;/h(H3,1,2,3,4); | CAS Common Chemistry |
| InChI Key | InChIKey=DITXJPASYXFQAS-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Nickel sulfamate | 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 | 154.918706856 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
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140
120
100
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60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
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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 = 155.79 g/mol. Edit any field — others recompute live.
