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Molecule
Ferrate(4-), Hexakis(Cyano-Κc)-, Ammonium (1:4), (Oc-6-11)-
CAS: 14481-29-9 · C6H16FeN10
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 14481-29-9
- Molecular Formula
- C6H16FeN10
- Molecular Mass
- 284.11 g/mol
Identifiers
CAS Registry Number
14481-29-9
SMILES
[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Fe+2].[NH4+].[NH4+].[NH4+].[NH4+]
InChI Key
ZXQVPEBHZMCRMC-UHFFFAOYSA-R
InChI
InChI=1S/6CN.Fe.4H3N/c6*1-2;;;;;/h;;;;;;;4*1H3/q6*-1;+2;;;;/p+4
Names and Synonyms
- Ferrate(4-), Hexakis(Cyano-Κc)-, Ammonium (1:4), (Oc-6-11)- Synonym
- Ferrate(4-), hexakis(cyano-κC)-, ammonium (1:4), (OC-6-11)- Synonym
- Ferrate(4-), hexacyano-, tetraammonium Synonym
- Ferrate(4-), hexakis(cyano-C)-, tetraammonium, (OC-6-11)- Synonym
- Ammonium ferrocyanide Synonym
- Ammonium hexacyanoferrate(II) Synonym
- Ferrate(4-), hexakis(cyano-κC)-, tetraammonium, (OC-6-11)- Synonym
- Ammonium ferrocyanide ((NH4)4[Fe(CN)6]) Synonym
- Tetraammonium hexacyanoferrate Synonym
- Tetraammonium hexacyanoferrate(4-) Synonym
- Tetraammonium ferrocyanide Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 284.11 g/mol | CAS Common Chemistry |
| 284.109 g/mol | RDKit | |
| 288.141 g/mol | chempirical lib | |
| Canonical SMILES | N#[C-][Fe+2]([C-]#N)([C-]#N)([C-]#N)([C-]#N)[C-]#N.[NH4+] | CAS Common Chemistry |
| InChI | InChI=1S/6CN.Fe.4H3N/c6*1-2;;;;;/h;;;;;;;4*1H3/q6*-1;+2;;;;/p+4 | CAS Common Chemistry |
| InChI Key | InChIKey=ZXQVPEBHZMCRMC-UHFFFAOYSA-R | CAS Common Chemistry |
| Name | Ferrate(4-), hexakis(cyano-κC)-, ammonium (1:4), (OC-6-11)- | CAS Common Chemistry |
| Heavy Atom Count | 17 | RDKit |
| Hydrogen Bond Acceptors | 6 | RDKit |
| Hydrogen Bond Donors | 4 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 288.74 Ų | RDKit |
| LogP | 2.0805199999999995 | RDKit |
| 2.0805 | RDKit | |
| Molar Refractivity | 53.74719999999997 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 284.09087801199996 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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200 ppm
180
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| 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.
External Resources
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MW = 284.11 g/mol. Edit any field — others recompute live.
