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Molecule
Silver Diethyldithiocarbamate
CAS: 1470-61-7 · C5H10AgNS2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 1470-61-7
- Molecular Formula
- C5H10AgNS2
- Molecular Mass
- 256.14 g/mol
Identifiers
CAS Registry Number
1470-61-7
SMILES
CCN(CC)C(=S)[S-].[Ag+]
InChI Key
NSVHDIYWJVLAGH-UHFFFAOYSA-M
InChI
InChI=1S/C5H11NS2.Ag/c1-3-6(4-2)5(7)8;/h3-4H2,1-2H3,(H,7,8);/q;+1/p-1
Names and Synonyms
- Silver Diethyldithiocarbamate Common Name
- Silver, (diethylcarbamodithioato-κS,κS′)- Synonym
- Silver, (diethyldithiocarbamato)- Synonym
- Silver, (diethylcarbamodithioato-S,S′)- Synonym
- (Diethylcarbamodithioato-κS,κS′)silver Synonym
- Silver diethyldithiocarbamate Synonym
- Silver(1+) diethyldithiocarbamate Synonym
- (Diethyldithiocarbamate)silver Synonym
- (Diethyldithiocarbamato)silver Synonym
- Carbamodithioic acid, diethyl-, silver(1+) salt Synonym
- NSC 378347 Synonym
- Carbamodithioic acid, N,N-diethyl-, silver(1+) salt (1:1) Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 256.14 g/mol | CAS Common Chemistry |
| 256.144 g/mol | RDKit | |
| 258.146 g/mol | chempirical lib | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Silver_diethyldithiocarbamate | CAS Common Chemistry |
| Canonical SMILES | [S]=1[Ag+][S-]C1N(CC)CC | CAS Common Chemistry |
| InChI | InChI=1S/C5H11NS2.Ag/c1-3-6(4-2)5(7)8;/h3-4H2,1-2H3,(H,7,8);/q;+1/p-1 | CAS Common Chemistry |
| InChI Key | InChIKey=NSVHDIYWJVLAGH-UHFFFAOYSA-M | CAS Common Chemistry |
| Melting Point | 172-175 °C | CAS Common Chemistry |
| Name | Silver diethyldithiocarbamate | CAS Common Chemistry |
| Heavy Atom Count | 9 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 2 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 3.24 Ų | RDKit |
| LogP | 1.1575 | RDKit |
| Molar Refractivity | 42.88400000000002 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.8 | RDKit |
| Exact Mass | 254.93056331999998 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
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.
External Resources
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MW = 256.14 g/mol. Edit any field — others recompute live.
