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(Sp-4-2)-Dichlorobis[1,1′-Thiobis[Ethane]]Platinum
CAS: 15442-57-6 | C8H20Cl2PtS2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
15442-57-6
Molecular Formula:
C8H20Cl2PtS2
Molecular Mass:
446.37 g/mol
Names and Synonyms:
(Sp-4-2)-Dichlorobis[1,1′-Thiobis[Ethane]]Platinum
Platinum, dichlorobis[1,1′-thiobis[ethane]]-, (SP-4-2)-
Platinum, dichlorobis(ethyl sulfide)-, cis-
(SP-4-2)-Dichlorobis[1,1′-thiobis[ethane]]platinum
cis-Dichlorobis(diethyl sulfide)platinum
cis-Dichlorobis(1,1′-thiobisethane)platinum
NSC 137445
cis-Dichlorobis(diethyl sulfide)platinum(II)
Identifiers:
SMILES:
CCSCC.CCSCC.[Cl-].[Cl-].[Pt+2]
InChI:
InChI=1S/2C4H10S.2ClH.Pt/c2*1-3-5-4-2;;;/h2*3-4H2,1-2H3;2*1H;/q;;;;+2/p-2
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 | 446.37 g/mol | CAS Common Chemistry |
| 446.366 g/mol | RDKit | |
| 445.0031391 g/mol | RDKit | |
| Canonical SMILES | [Cl-][Pt+2]([Cl-])([S](CC)CC)[S](CC)CC | CAS Common Chemistry |
| InChI | InChI=1S/2C4H10S.2ClH.Pt/c2*1-3-5-4-2;;;/h2*3-4H2,1-2H3;2*1H;/q;;;;+2/p-2 | CAS Common Chemistry |
| InChI Key | InChIKey=DCIVLRIRJUWCIS-UHFFFAOYSA-L | CAS Common Chemistry |
| Name | (SP-4-2)-Dichlorobis[1,1′-thiobis[ethane]]platinum | CAS Common Chemistry |
| Heavy Atom Count | 13 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 4 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 0.0 Ų | RDKit |
| LogP | -2.4756999999999962 | RDKit |
| Molar Refractivity | 57.346000000000046 | RDKit |
