Dicarbonylchloro(4-methylbenzenamine)iridium

Catalog Number	ACM14243222
CAS	14243-22-2
Synonyms	Cis-[IrCl(CO)2(p-toluidine)]
Molecular Weight	389.83
Molecular Formula	C9H8ClIrNO2
Canonical SMILES	CC1=CC(=C(C=C1)N)Cl(=C=O)=C=O.[Ir]
InChI	InChI=1S/C9H8ClNO2.Ir/c1-7-2-3-9(11)8(4-7)10(5-12)6-13;/h2-4H,11H2,1H3;
InChI Key	BVCZKVKOKNWCSV-UHFFFAOYSA-N
Purity	98%
Complexity	288
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Exact Mass	389.98728
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Monoisotopic Mass	389.98728
Rotatable Bond Count	1
Topological Polar Surface Area	60.2 Ų