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Vanadium(V) Oxytrifluoride
CAS: 13709-31-4 | F3OV
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
13709-31-4
Molecular Formula:
F3OV
Molecular Weight:
123.937 g/mol
Names and Synonyms:
Vanadium(V) Oxytrifluoride
Vanadium trifluoride monoxide
Vanadium fluoride oxide (VF3O)
Vanadium oxide fluoride (VOF3)
Vanadyl trifluoride
Vanadium oxofluoride (VOF3)
Vanadium oxytrifluoride
Vanadium oxyfluoride (VOF3)
Vanadium, trifluorooxo-
Vanadyl fluoride (VOF3)
Vanadium fluoride oxide (VOF3)
Vanadium, trifluorooxo-, (T-4)-
Identifiers:
SMILES:
[F-].[F-].[F-].[O].[V+3]
InChI:
InChI=1S/3FH.O.V/h3*1H;;/q;;;;+3/p-3
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
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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 | 123.937 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 123.93408378000002 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 5 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 | -9.1093 | RDKit |
| molecular_mass | 123.94 g/mol | Legacy Database |
| density | 2.46 g/cm³ | Legacy Database |
| wikipedia_url | https://en.wikipedia.org/wiki/Vanadium(V)_oxytrifluoride None | Legacy Database |
| cas-boiling-point | 480 °C None | Legacy Database |
| cas-canonical-smile | O=[V](F)(F)F None | Legacy Database |
| cas-density | 2.4591 g/cm3 @ Temp: 20.5 °C None | Legacy Database |
| cas-inchi | InChI=1S/3FH.O.V/h3*1H;;/q;;;;+3/p-3 None | Legacy Database |
| cas-inchi-key | InChIKey=FXGIDXZUDLFPLD-UHFFFAOYSA-K None | Legacy Database |
| cas-melting-point | 300 °C None | Legacy Database |
| cas-name | Vanadium, trifluorooxo-, (T-4)- None | Legacy Database |
| wikipedia-name | Vanadium(V) oxytrifluoride None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 0.6865 | RDKit |
