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Cuprate(1-), Bis(Cyano-Κc)-, Potassium (1:1)
CAS: 13682-73-0 | C2CuKN2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
13682-73-0
Molecular Formula:
C2CuKN2
Molecular Weight:
154.68 g/mol
Names and Synonyms:
Cuprate(1-), Bis(Cyano-Κc)-, Potassium (1:1)
Potassium dicyanocuprate(1-)
Cuprous potassium cyanide
Potassium copper(I) cyanide
Copper(I) potassium cyanide
Cuprate(1-), bis(cyano-κC)-, potassium
Potassium cyanocuprate(I) (KCu(CN)2)
Potassium dicyanocuprate(I)
Cuprate(1-), bis(cyano-C)-, potassium
Cuprate(1-), dicyano-, potassium
Cuprate(1-), bis(cyano-κC)-, potassium (1:1)
Identifiers:
SMILES:
[C-]#N.[C-]#N.[Cu+].[K+]
InChI:
InChI=1S/2CN.Cu.K/c2*1-2;;/q2*-1;2*+1
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
| Category | Property | Value | Source |
|---|---|---|---|
| Molecular | Molecular Weight | 154.68 g/mol | RDKit |
| Exact | Exact Molecular Weight | 153.89945218 g/mol | RDKit |
| Heavy | Heavy Atom Count | 6 count | RDKit |
| Hydrogen | Hydrogen Bond Acceptors | 2 count | RDKit |
| Hydrogen Bond Donors | 0 count | RDKit | |
| Rotatable | Rotatable Bonds | 0 count | RDKit |
| Aromatic | Aromatic Ring Count | 0 count | RDKit |
| Topological | Topological Polar Surface Area | 47.58 Ų | RDKit |
| Physical Properties | LogP | -2.80576 | RDKit |
| molecular_mass | 154.68 g/mol | Legacy Database | |
| cas-canonical-smile | [K+].N#[C-][Cu+][C-]#N | Legacy Database | |
| cas-inchi | InChI=1S/2CN.Cu.K/c2*1-2;;/q2*-1;2*+1 | Legacy Database | |
| cas-inchi-key | InChIKey=IVDPWEKOUUEEBD-UHFFFAOYSA-N | Legacy Database | |
| cas-name | Cuprate(1-), bis(cyano-κC)-, potassium (1:1) | Legacy Database | |
| Molar | Molar Refractivity | 9.936 | RDKit |
