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- ChemComp-I83: bis(chloranyl)-(dimethylamino)-(methylamino)platinum -

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Basic information

EntryDatabase: PDB chemical components / ID: I83
NameName: bis(chloranyl)-(dimethylamino)-(methylamino)platinum
Synonyms: trans-dimethylamine methylamine dichlorido platinum(II)

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Chemical information

Composition
Formula: C3H10Cl2N2Pt / Number of atoms: 18 / Formula weight: 340.109 / Formal charge: 0
Others

4qh3

Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: I83 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 4QH3
History
Create componentJun 9, 2014
Modify synonymsJun 19, 2014
Initial releaseJul 30, 2014
Modify synonymsMar 1, 2021
External linksUniChem / ChemSpider / Wikipedia search / Google search

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

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Details

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SMILES

ACDLabs 12.01Cl[Pt](Cl)(NC)N(C)C
CACTVS 3.385CN[Pt](Cl)(Cl)N(C)C
OpenEye OEToolkits 1.7.6CN[Pt](N(C)C)(Cl)Cl

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SMILES CANONICAL

CACTVS 3.385CN[Pt](Cl)(Cl)N(C)C
OpenEye OEToolkits 1.7.6CN[Pt](N(C)C)(Cl)Cl

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InChI

InChI 1.03InChI=1S/C2H6N.CH4N.2ClH.Pt/c1-3-2;1-2;;;/h1-2H3;2H,1H3;2*1H;/q2*-1;;;+4/p-2

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InChIKey

InChI 1.03XAGGIHWWXSGPFS-UHFFFAOYSA-L

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SYSTEMATIC NAME

ACDLabs 12.01platinum(4+) chloride dimethylazanide methylazanide (1:2:1:1)
OpenEye OEToolkits 1.7.6bis(chloranyl)-(dimethylamino)-(methylamino)platinum

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PDB entries

Showing all 2 items

PDB-4qgz:
X-ray structure of the adduct formed between hen egg white lysozyme and trans-dimethylamine methylamine dichlorido platinum(II)

PDB-4qh3:
X-ray structure of the adduct formed between bovine pancreatic ribonuclease and trans-dimethylamine methylamine dichlorido platinum(II)

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