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C-H Activation
Chloro[(1,2,3,4,5,6-η)-2,2'',4,4'',6,6''-hexamethyl[1,1':3',1''-terphenyl]-2'-thiolato-κS][tris(4-fluorophenyl)phosphine-κP]ruthenium(II)(CAS RN:1420299-84-8 Product Number:C3328)

Chloro[(1,2,3,4,5,6-η)-2,2'',4,4'',6,6''-hexamethyl[1,1':3',1''-terphenyl]-2'-thiolato-κS][tris(4-fluorophenyl)phosphine-κP]ruthenium(II)(CAS RN:1420299-84-8 Product Number:C3328)

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Catalog Number

ACM1420299848

Product Name

CAS

1420299-84-8

Product Overview

Synonyms

1420299-84-8;Chloro[(1,2,3,4,5,6-eta)-2,2'',4,4'',6,6''-hexamethyl[1,1':3',1''-terphenyl]-2'-thiolato-kappaS][tris(4-fluorophenyl)phosphine-kappaP]ruthenium(II);

IUPAC Name

2,6-bis(2,4,6-trimethylphenyl)benzenethiolate;chlororuthenium(1+);tris(4-fluorophenyl)phosphane;

Molecular Weight

798.307g/mol

Molecular Formula

C42H37ClF3PRuS;

Canonical SMILES

CC1=CC(=C(C(=C1)C)C2=C(C(=CC=C2)C3=C(C=C(C=C3C)C)C)[S-])C.C1=CC(=CC=C1F)P(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F.Cl[Ru+];

InChI

InChI=1S/C24H26S.C18H12F3P.ClH.Ru/c1-14-10-16(3)22(17(4)11-14)20-8-7-9-21(24(20)25)23-18(5)12-15(2)13-19(23)6;19-13-1-7-16(8-2-13)22(17-9-3-14(20)4-10-17)18-11-5-15(21)6-12-18;;/h7-13,25H,1-6H3;1-12H;1H;/q;;;+2/p-2;

InChI Key

PCBRQBCMBTZBQC-UHFFFAOYSA-L;

Complexity

657

Covalently-Bonded Unit Count

Exact Mass

798.104g/mol

H-Bond Acceptor

Heavy Atom Count

Monoisotopic Mass

798.104g/mol

Rotatable Bond Count

Topological Polar Surface Area

1A^2

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