Bis(benzonitrile)dichloroplatinum(II) - Pt ≥41.0% , CAS No.14873-63-3

CAS: 14873-63-3 Cat. No.: B113726 Molecular Weight: 472.24 EC Number: 238-943-7 PubChem CID: 6093685

GRADE & PURITY Pt ≥41.0%

Synonyms

14873-63-3|Bis(benzonitrile)dichloroplatinum(II)|Dichlorobis(benzonitrile)platinum(II)|Bis(benzonitrile)dichloroplatinum|benzonitrile;dichloroplatinum|cis-Bis(benzonitrile)dichloroplatinum(II)|15617-19-3|EINECS 238-943-7|Platinum, bis(benzonitrile)dichlor

Storage

Room temperature,Desiccated

Shipped In

Normal

Specifications

Synonyms

14873-63-3 | Bis(benzonitrile)dichloroplatinum(II) | Dichlorobis(benzonitrile)platinum(II) | Bis(benzonitrile)dichloroplatinum | benzonitrile;dichloroplatinum | cis-Bis(benzonitrile)dichloroplatinum(II) | 15617-19-3 | EINECS 238-943-7 | Platinum, bis(benzonitrile)dichlor

Specifications & Purity

Pt ≥41.0%

Storage

Room temperature, Desiccated

Shipped In

Normal

Names and Identifiers

• Pubchem Sid: 488195655
• Canonical Smiles: C1=CC=C(C=C1)C#N.C1=CC=C(C=C1)C#N.Cl[Pt]Cl
• IUPAC Name: benzonitrile;dichloroplatinum
• InChIKey: WAJRCRIROYMRKA-UHFFFAOYSA-L
• INCHI: 1S/2C7H5N.2ClH.Pt/c2*8-6-7-4-2-1-3-5-7;;;/h2*1-5H;2*1H;/q;;;;+2/p-2
• Isomeric SMILES: C1=CC=C(C=C1)C#N.C1=CC=C(C=C1)C#N.Cl[Pt]Cl
• Alternate CAS: 15617-19-3
• PubChem CID: 6093685
• Molecular Weight: 472.24

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Class Benzene and substituted derivatives
      • Subclass Benzonitriles

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Benzene and substituted derivatives
• Subclass: Benzonitriles
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzonitriles
• Alternative Parents: Nitriles Organopnictogen compounds Organic salts Hydrocarbon derivatives
• Molecular Framework: Not available
• Substituents: Benzonitrile - Nitrile - Carbonitrile - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organic salt - Organonitrogen compound - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as benzonitriles. These are organic compounds containing a benzene bearing a nitrile substituent.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemical and Physical Properties

• Molecular Weight: 472.200 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 470.987 Da
• Monoisotopic Mass: 470.987 Da
• Topological Polar Surface Area: 47.600 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 106.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 3

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