Chlorodihydrotris(triphenylphosphine)iridium

Catalog Number	ACM17035595-1
CAS	17035-59-5
Structure
Synonyms	Hydride;iridium(3+);triphenylphosphane;chloride
Molecular Weight	1016.5
Molecular Formula	C54H47ClIrP3
Canonical SMILES	[H-].[H-].C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-].[Ir+3]
InChI	InChI=1S/3C18H15P.ClH.Ir.2H/c3*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;/h3*1-15H;1H;/q;+3;2*-1/p-1
InChI Key	RHBKEKKWKABSMQ-UHFFFAOYSA-M
Exact Mass	1016.22084
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Monoisotopic Mass	1016.22084
Rotatable Bond Count	9
Topological Polar Surface Area	0 Ų