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Molecule
Ferrate(4-), Hexakis(Cyano-Κc)-, Sodium, Hydrate (1:4:10), (Oc-6-11)-
CAS: 14434-22-1 · C6H20FeN6Na4O10
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 14434-22-1
- Molecular Formula
- C6H20FeN6Na4O10
- Molecular Mass
- 484.06 g/mol
Identifiers
CAS Registry Number
14434-22-1
SMILES
O.O.O.O.O.O.O.O.O.O.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Fe+2].[Na+].[Na+].[Na+].[Na+]
InChI Key
JFSUDVTVQZUDOP-UHFFFAOYSA-N
InChI
InChI=1S/6CN.Fe.4Na.10H2O/c6*1-2;;;;;;;;;;;;;;;/h;;;;;;;;;;;10*1H2/q6*-1;+2;4*+1;;;;;;;;;;
Names and Synonyms
- Ferrate(4-), Hexakis(Cyano-Κc)-, Sodium, Hydrate (1:4:10), (Oc-6-11)- Systematic Name
- Ferrate(4-), hexakis(cyano-κC)-, sodium, hydrate (1:4:10), (OC-6-11)- Synonym
- Ferrate(4-), hexacyano-, tetrasodium, decahydrate Synonym
- Ferrate(4-), hexakis(cyano-C)-, tetrasodium, decahydrate, (OC-6-11)- Synonym
- Yellow prussiate of soda Synonym
- Sodium hexacyanoferrate (Na4(Fe(CN)6)), decahydrate Synonym
- Tetrasodium hexacyanoferrate(4-) decahydrate Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 484.06 g/mol | CAS Common Chemistry |
| 484.0630000000001 g/mol | RDKit | |
| 484.063 g/mol | RDKit | |
| 496.159 g/mol | chempirical lib | |
| Canonical SMILES | [Na+].N#[C-][Fe+2]([C-]#N)([C-]#N)([C-]#N)([C-]#N)[C-]#N.O | CAS Common Chemistry |
| InChI | InChI=1S/6CN.Fe.4Na.10H2O/c6*1-2;;;;;;;;;;;;;;;/h;;;;;;;;;;;10*1H2/q6*-1;+2;4*+1;;;;;;;;;; | CAS Common Chemistry |
| InChI Key | InChIKey=JFSUDVTVQZUDOP-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Ferrate(4-), hexakis(cyano-κC)-, sodium, hydrate (1:4:10), (OC-6-11)- | CAS Common Chemistry |
| Heavy Atom Count | 27 | RDKit |
| Hydrogen Bond Acceptors | 6 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 457.7400000000001 Ų | RDKit |
| 457.74 Ų | RDKit | |
| LogP | -19.655280000000015 | RDKit |
| -19.6553 | RDKit | |
| Molar Refractivity | 65.94600000000005 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 484.01810546000013 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
9
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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.
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MW = 484.06 g/mol. Edit any field — others recompute live.
