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Samarium(Iii) Nitrate
CAS: 13759-83-6 | H5NO5Sm
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
13759-83-6
Molecular Formula:
H5NO5Sm
Molecular Mass:
249.40 g/mol
Names and Synonyms:
Samarium(Iii) Nitrate
Nitric acid, samarium(3+) salt, hydrate (3:1:6)
Nitric acid, samarium(3+) salt, hexahydrate
Samarium trinitrate hexahydrate
Samarium nitrate (Sm(NO3)3) hexahydrate
Samarium nitrate hexahydrate (Sm[NO3]3•6H2O)
Samarium nitrate hexahydrate
Identifiers:
SMILES:
O.O.O=[N+]([O-])O.[Sm]
InChI:
InChI=1S/HNO3.2H2O.Sm/c2-1(3)4;;;/h(H,2,3,4);2*1H2;
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 | 249.40 g/mol | CAS Common Chemistry |
| 249.402 g/mol | RDKit | |
| 250.93650466 g/mol | RDKit | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Samarium(III)_nitrate | CAS Common Chemistry |
| Canonical SMILES | [Sm].O=N(=O)O.O | CAS Common Chemistry |
| InChI | InChI=1S/HNO3.2H2O.Sm/c2-1(3)4;;;/h(H,2,3,4);2*1H2; | CAS Common Chemistry |
| InChI Key | InChIKey=WDYZAPZCSHVMPO-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Samarium trinitrate hexahydrate | CAS Common Chemistry |
| Samarium(III) nitrate | CAS Common Chemistry | |
| Heavy Atom Count | 7 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 126.37 Ų | RDKit |
| LogP | -1.9971 | RDKit |
| Molar Refractivity | 16.008499999999998 | RDKit |
