[NH2Me2][(RuCl((R)-xylbinap))2(μ-Cl)3]

• CAS: 944451-08-5
• Catalog Number: ACM944451085
• Category: Ruthenium series catalysts
• Molecular Weight: 1898.314g/mol
• Molecular Formula: C106H107Cl5NP4Ru2+
• Synonyms: 944451-08-5; SC10186; NH2ME2][(RUCL((S)-XYLBINAP))2(MU-CL)3; Dimethylammonium dichlorotri(|I-chloro)bis[(R)-(+)-2,2 inverted exclamation marka-bis[di(3,5-xylyl)phosphino]-1,1 inverted exclamation marka-binaphthyl]diruthenate(II); Dimethylammonium dichlorotri(mu-chloro)bis{(R)-(+)-2,2'-bis[di(3,5-xylyl)phosphino]-1,1'-binaphthyl}diruthenate(II), [NH2Me2][{RuCl((R)-xylbinap)}2(mu-Cl)3]; DIMETHYLAMMONIUM DICHLOROTRI(MU-CHLORO)BIS[(R)-(+)-2,2'-BIS[DI(3,5-XYLYL)PHOSPHINO]-1,1'-BINAPHTHYL]DIRUTHENATE(II); DIMETHYLAMMONIUM DICHLOROTRI(MU-CHLORO)BIS[(S)-(-)-2,2'-BIS[DI(3,5-XYLYL)PHOSPHINO]-1,1'-BINAPHTHYL]DIRUTHENATE(II); (S)-[(RUCL(DM-BINAP))2(MU-CL)3][NH2ME2]
• IUPAC Name: [1-[2-bis(3,5-dimethylphenyl)phosphanylnaphthalen-1-yl]naphthalen-2-yl]-bis(3,5-dimethylphenyl)phosphane;N-methylmethanamine;ruthenium;trichloronioruthenium(1-);chloride;hydrochloride
• Canonical SMILES: CC1=CC(=CC(=C1)P(C2=C(C3=CC=CC=C3C=C2)C4=C(C=CC5=CC=CC=C54)P(C6=CC(=CC(=C6)C)C)C7=CC(=CC(=C7)C)C)C8=CC(=CC(=C8)C)C)C.CC1=CC(=CC(=C1)P(C2=C(C3=CC=CC=C3C=C2)C4=C(C=CC5=CC=CC=C54)P(C6=CC(=CC(=C6)C)C)C7=CC(=CC(=C7)C)C)C8=CC(=CC(=C8)C)C)C.CNC.Cl.[Cl-].[ClH+][Ru-]([ClH+])[ClH+].[Ru]
• InChI: InChI=1S/2C52H48P2.C2H7N.5ClH.2Ru/c2*1-33-21-34(2)26-43(25-33)53(44-27-35(3)22-36(4)28-44)49-19-17-41-13-9-11-15-47(41)51(49)52-48-16-12-10-14-42(48)18-20-50(52)54(45-29-37(5)23-38(6)30-45)46-31-39(7)24-40(8)32-46;1-3-2;;;;;;;/h2*9-32H,1-8H3;3H,1-2H3;5*1H;;/q;;;;;;;;;+2/p-1
• InChI Key: LJSDQAUPXVWQNF-UHFFFAOYSA-M
• Application: Catalyst system for asymmetric hydrogenation.
• Storage: 2-8°C
• Complexity: 1010
• Covalently-Bonded Unit Count: 7
• Exact Mass: 1901.39g/mol
• Formal Charge: 1
• H-Bond Acceptor: 3
• H-Bond Donor: 5
• Heavy Atom Count: 118
• Monoisotopic Mass: 1896.388g/mol
• Rotatable Bond Count: 14
• Topological Polar Surface Area: 12A^2