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Nickel(Ii) Oxide
CAS: 1313-99-1 | NiO
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
1313-99-1
Molecular Formula:
NiO
Molecular Weight:
74.692 g/mol
Names and Synonyms:
Nickel(Ii) Oxide
Common Name
Avantama P21
Synonym
High purity nickel oxide F
Synonym
NiO-FP
Synonym
NiO-D
Synonym
NiO-G 39
Synonym
Nickel oxide
Synonym
Nickel Oxide Sinter 75
Synonym
Mononickel oxide
Synonym
Nickel(2+) oxide
Synonym
Nickel monoxide
Synonym
Nickel(II) oxide
Synonym
Nickelous oxide
Synonym
Nickel monooxide
Synonym
Nickel oxide (NiO)
Synonym
Identifiers:
SMILES:
[Ni].[O]
InChI:
InChI=1S/Ni.O
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
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5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
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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.
All Properties
Comprehensive physical and chemical properties
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 74.692 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 73.93025752 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 2 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 0 count | RDKit |
| Hydrogen Bond Donors | 0 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 0 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 0 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 28.5 Ų | RDKit |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | -0.1213 | RDKit |
| cas-melting-point | 1955 °C None | Legacy Database |
| wikipedia-name | Nickel(II) oxide None | Legacy Database |
| cas-name | Nickel monoxide None | Legacy Database |
| molecular_mass | 74.69 g/mol | Legacy Database |
| density | 6.72 g/cm³ | Legacy Database |
| wikipedia_url | https://en.wikipedia.org/wiki/Nickel(II)_oxide None | Legacy Database |
| cas-canonical-smile | O=[Ni] None | Legacy Database |
| cas-density | 6.72 g/cm3 None | Legacy Database |
| cas-inchi | InChI=1S/Ni.O None | Legacy Database |
| cas-inchi-key | InChIKey=GNRSAWUEBMWBQH-UHFFFAOYSA-N None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 0.6865 | RDKit |