Chloro[(R)-2,2'-bis(diphenylphosphino)-1,1'-binaphthyl][(1R,2R)-2-(diphenylphosphino)-1,2-diphenylethanamine]ruthenium(II) tetrafluoroborate

Catalog Number	ACM1150112541-1
CAS	1150112-54-1
Structure
Synonyms	2-Diphenylphosphanyl-1,2-diphenylethanamine;[1-(2-diphenylphosphanylnaphthalen-1-yl)naphthalen-2-yl]-diphenylphosphane;ruthenium(2+);chloride;tetrafluoroborate
Molecular Weight	1227.4
Molecular Formula	C70H56BClF4NP3Ru
Canonical SMILES	[B-](F)(F)(F)F.C1=CC=C(C=C1)C(C(C2=CC=CC=C2)P(C3=CC=CC=C3)C4=CC=CC=C4)N.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=C(C4=CC=CC=C4C=C3)C5=C(C=CC6=CC=CC=C65)P(C7=CC=CC=C7)C8=CC=CC=C8.[Cl-].[Ru+2]
InChI	InChI=1S/C44H32P2.C26H24NP.BF4.ClH.Ru/c1-5-19-35(20-6-1)45(36-21-7-2-8-22-36)41-31-29-33-17-13-15-27-39(33)43(41)44-40-28-16-14-18-34(40)30-32-42(44)46(37-23-9-3-10-24-37)38-25-11-4-12-26-38;27-25(21-13-5-1-6-14-21)26(22-15-7-2-8-16-22)28(23-17-9-3-10-18-23)24-19-11-4-12-20-24;2-1(3,4)5;/h1-32H;1-20,25-26H,27H2;1H;/q;-1;+2/p-1
InChI Key	XCERQXGLTGTHLA-UHFFFAOYSA-M
Purity	97%
Appearance	Solid
Exact Mass	1227.238673
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	1
Monoisotopic Mass	1227.238673
Rotatable Bond Count	13
Topological Polar Surface Area	26 Ų