trichloroiridium pentaamine

• ChemBase ID: 149136
• Molecular Formular: Cl3H15IrN5
• Molecular Mass: 383.7286
• Monoisotopic Mass: 383.00222955
• SMILES: N.N.N.N.N.Cl[Ir](Cl)Cl
• Canonical SMILES: Cl[Ir](Cl)Cl.N.N.N.N.N
• InChI: InChI=1S/3ClH.Ir.5H3N/h3*1H;;5*1H3/q;;;+3;;;;;/p-3
• InChIKey: DYGMZANLQHDDSH-UHFFFAOYSA-K

NAMES AND DATABASE IDS

Names

• IUPAC name: trichloroiridium pentaamine
• IUPAC Traditional name: trichloroiridium pentaamine
• Synonyms: Pentaamminechloroiridium(III) chloride; 二氯化戊氨络物氯铱(III)

Database IDs

• CAS Number: 15742-38-8
• EC Number: 239-833-1
• MDL Number: MFCD00798542
• PubChem SID: 162243304; 24877669
• PubChem CID: 15541975

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 1.9035
• LogD (pH = 7.4): 1.9035
• Log P: 1.9035
• Molar Refractivity: 18.4089 cm^3
• Polarizability: 14.595319 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: powder
• Melting Point: >300 °C(lit.)

Safety Information

• German water hazard class: 3
• Personal Protective Equipment: Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter

Product Information

• Purity: 99.95% trace metals basis
• Linear Formula: [Ir(NH3)5Cl]Cl2

DETAILS

Sigma Aldrich - 529281

Packaging
1 g in glass bottle