[1-[2-Bis(4-methylphenyl)phosphanylnaphthalen-1-yl]naphthalen-2-yl]-bis(4-methylphenyl)phosphane;dichlororuthenium;N-methylmethanamine;hydrochloride

Catalog Number	ACM309735862-1
CAS	309735-86-2
Structure
Synonyms	Dimethylammoniumdichlorotri(mu-chloro)bis[(S)-(-)-2,2'-bis(di-p-tolylphosphino)-1,1'-binaphthyl]diruthenate(II)
Molecular Weight	1783
Molecular Formula	C98H88Cl5NP4Ru2
Canonical SMILES	CC1=CC=C(C=C1)P(C2=CC=C(C=C2)C)C3=C(C4=CC=CC=C4C=C3)C5=C(C=CC6=CC=CC=C65)P(C7=CC=C(C=C7)C)C8=CC=C(C=C8)C.CC1=CC=C(C=C1)P(C2=CC=C(C=C2)C)C3=C(C4=CC=CC=C4C=C3)C5=C(C=CC6=CC=CC=C65)P(C7=CC=C(C=C7)C)C8=CC=C(C=C8)C.CNC.Cl.Cl[Ru]Cl.Cl[Ru]Cl
InChI	InChI=1S/2C48H40P2.C2H7N.5ClH.2Ru/c2*1-33-13-23-39(24-14-33)49(40-25-15-34(2)16-26-40)45-31-21-37-9-5-7-11-43(37)47(45)48-44-12-8-6-10-38(44)22-32-46(48)50(41-27-17-35(3)18-28-41)42-29-19-36(4)20-30-42;1-3-2;/h2*5-32H,1-4H3;3H,1-2H3;5*1H;/q;2*+2/p-4
InChI Key	FAAFCSOHMVBJIS-UHFFFAOYSA-J
Melting Point	>100 °C
Appearance	Powder
Exact Mass	1786.24116
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	2
Monoisotopic Mass	1781.239669
Rotatable Bond Count	14
Topological Polar Surface Area	12 Ų