(Ir[dF(CF3)ppy]2(dtbpy))PF6

Catalog Number

ACM870987636-2

CAS

870987-63-6

Structure

Synonyms

Hexafluorophosphate

IUPAC Name

4-tert-butyl-2-(4-tert-butylpyridin-2-yl)pyridine;2-(2,4-difluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;ruthenium(3+);hexafluorophosphate

Molecular Weight

1121.93

Molecular Formula

C42H34F16IrN4P

Canonical SMILES

CC(C)(C)C1=CC(=NC=C1)C2=NC=CC(=C2)C(C)(C)C.C1=CC(=NC=C1C(F)(F)F)C2=C(C=C(C=[C-]2)F)F.C1=CC(=NC=C1C(F)(F)F)C2=C(C=C(C=[C-]2)F)F.F[P-](F)(F)(F)(F)F.[Ru+3]

InChI

InChI=1S/C18H24N2.2C12H5F5N.F6P.Ru/c1-17(2,3)13-7-9-19-15(11-13)16-12-14(8-10-20-16)18(4,5)6;2*13-8-2-3-9(10(14)5-8)11-4-1-7(6-18-11)12(15,16)17;1-7(2,3,4,5)6;/h7-12H,1-6H3;2*1-2,4-6H;;/q;3*-1;+3

InChI Key

ZUCAVAHGAUORTF-UHFFFAOYSA-N

Melting Point

>300 °C

Purity

95%

Appearance

Yellow powder

Storage

Inert atmosphere,2 - 8 °C

• Catalog Number: ACM870987636-2
• CAS: 870987-63-6
• Synonyms: Hexafluorophosphate
• IUPAC Name: 4-tert-butyl-2-(4-tert-butylpyridin-2-yl)pyridine;2-(2,4-difluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;ruthenium(3+);hexafluorophosphate
• Molecular Weight: 1121.93
• Molecular Formula: C42H34F16IrN4P
• Canonical SMILES: CC(C)(C)C1=CC(=NC=C1)C2=NC=CC(=C2)C(C)(C)C.C1=CC(=NC=C1C(F)(F)F)C2=C(C=C(C=[C-]2)F)F.C1=CC(=NC=C1C(F)(F)F)C2=C(C=C(C=[C-]2)F)F.F[P-](F)(F)(F)(F)F.[Ru+3]
• InChI: InChI=1S/C18H24N2.2C12H5F5N.F6P.Ru/c1-17(2,3)13-7-9-19-15(11-13)16-12-14(8-10-20-16)18(4,5)6;2*13-8-2-3-9(10(14)5-8)11-4-1-7(6-18-11)12(15,16)17;1-7(2,3,4,5)6;/h7-12H,1-6H3;2*1-2,4-6H;;/q;3*-1;+3
• InChI Key: ZUCAVAHGAUORTF-UHFFFAOYSA-N
• Melting Point: >300 °C
• Purity: 95%
• Appearance: Yellow powder
• Storage: Inert atmosphere,2 - 8 °C