Back to Search
Molecule
Dichloro(Ethylenediamine)Platinum(Ii)
CAS: 14096-51-6 · C2H8Cl2N2Pt
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 14096-51-6
- Molecular Formula
- C2H8Cl2N2Pt
- Molecular Mass
- 326.08 g/mol
Identifiers
CAS Registry Number
14096-51-6
SMILES
NCCN.[Cl-].[Cl-].[Pt+2]
InChI Key
LMABILRJNNFCPG-UHFFFAOYSA-L
InChI
InChI=1S/C2H8N2.2ClH.Pt/c3-1-2-4;;;/h1-4H2;2*1H;/q;;;+2/p-2
Names and Synonyms
- Dichloro(Ethylenediamine)Platinum(Ii) Common Name
- Platinum, dichloro(1,2-ethanediamine-κN1,κN2)-, (SP-4-2)- Synonym
- Platinum, dichloro(ethylenediamine)- Synonym
- Platinum, dichloro(1,2-ethanediamine-N,N′)-, (SP-4-2)- Synonym
- Platinum, dichloro(1,2-ethanediamine-κN,κN′)-, (SP-4-2)- Synonym
- (SP-4-2)-Dichloro(1,2-ethanediamine-κN1,κN2)platinum Synonym
- Dichloro(ethylenediamine)platinum(II) Synonym
- Platinum ethylenediamine dichloride Synonym
- cis-Dichloro ethylenediammine platinum Synonym
- cis-Dichloro(ethylenediamine)platinum Synonym
- Dichloro(1,2-diaminoethane)platinum Synonym
- NSC 125181 Synonym
- Dichloro(ethane-1,2-diamine)platinum(II) Synonym
- Enplatin Synonym
- CPA 3 Synonym
- Dichloro(1,2-ethanediamine)platinum Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 326.08 g/mol | CAS Common Chemistry |
| 326.084 g/mol | RDKit | |
| 330.116 g/mol | chempirical lib | |
| Canonical SMILES | [Cl-][Pt+2]1([Cl-])[NH2]CC[NH2]1 | CAS Common Chemistry |
| InChI | InChI=1S/C2H8N2.2ClH.Pt/c3-1-2-4;;;/h1-4H2;2*1H;/q;;;+2/p-2 | CAS Common Chemistry |
| InChI Key | InChIKey=LMABILRJNNFCPG-UHFFFAOYSA-L | CAS Common Chemistry |
| Name | Dichloro(ethylenediamine)platinum(II) | CAS Common Chemistry |
| Heavy Atom Count | 7 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 1 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 52.04 Ų | RDKit |
| LogP | -7.090699999999998 | RDKit |
| -7.0907 | RDKit | |
| Molar Refractivity | 18.108800000000006 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 324.971244716 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
Convert
Quick conversion
MW = 326.08 g/mol. Edit any field — others recompute live.
