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Iodine Pentafluoride
CAS: 7783-66-6 | F5I
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
7783-66-6
Molecular Formula:
F5I
Molecular Mass:
221.89 g/mol
Names and Synonyms:
Iodine Pentafluoride
Iodine fluoride (IF5)
Iodine pentafluoride
Pentafluoroiodine
Identifiers:
SMILES:
FI(F)(F)(F)F
InChI:
InChI=1S/F5I/c1-6(2,3,4)5
Key Properties
Boiling Point
100.5 °C
CAS Common Chemistry
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 | 221.89 g/mol | CAS Common Chemistry |
| 221.89399999999995 g/mol | RDKit | |
| 221.8964891 g/mol | RDKit | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Iodine_pentafluoride | CAS Common Chemistry |
| Boiling Point | 100.5 °C | CAS Common Chemistry |
| Canonical SMILES | FI(F)(F)(F)F | CAS Common Chemistry |
| InChI | InChI=1S/F5I/c1-6(2,3,4)5 | CAS Common Chemistry |
| InChI Key | InChIKey=PJIYEPACCBMRLZ-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Iodine pentafluoride | CAS Common Chemistry |
| Heavy Atom Count | 6 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 0.0 Ų | RDKit |
| LogP | 2.9867 | RDKit |
| Molar Refractivity | 19.560000000000002 | RDKit |
