Tris[2-(p-tolyl)pyridine]iridium(iii)

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Catalog Number
ACM800394585-2
Product Name
Tris[2-(p-tolyl)pyridine]iridium(iii)
Structure
Structure
CAS
800394-58-5
Category
Heterocyclic Organic Compound
Synonyms
Tris[2-(p-tolyl)pyridine]iridium(III);Tris[2-(p-tolyl)pyridine]iridium(Ⅲ);IR(MPPY)3;Iridium,tris[2-(4-tolylphenyl)pyridinato-N,C2'];Tris(5-methyl-2-(pyridin-2-yl)phenyl)iridium
IUPAC Name
Iridium(3+);2-(4-methylbenzene-6-id-1-yl)pyridine
Molecular Weight
696.9
Molecular Formula
C36H30IrN3
Canonical SMILES
CC1=C[C-]=C(C=C1)C2=CC=CC=N2.CC1=C[C-]=C(C=C1)C2=CC=CC=N2.CC1=C[C-]=C(C=C1)C2=CC=CC=N2.[Ir+3]
InChI
InChI=1S/3C12H10N.Ir/c3*1-10-5-7-11(8-6-10)12-4-2-3-9-13-12;/h3*2-7,9H,1H3;/q3*-1;+3
InChI Key
KDWBDFNGFJZGNZ-UHFFFAOYSA-N
Complexity
957
Covalently-Bonded Unit Count
4
Exact Mass
697.2069g/mol
Formal Charge
0
H-Bond Acceptor
6
H-Bond Donor
0
Heavy Atom Count
40
Monoisotopic Mass
697.2069g/mol
Rotatable Bond Count
3
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