Chloro(pentamethylcyclopentadienyl){5-methoxy-2-{1-[(4-methoxyphenyl)imino-kN]ethyl}phenyl-kC}iridium(III)

Catalog Number	ACM1258964485-1
CAS	1258964-48-5
Synonyms	Chloro(5-methoxy-2-{1-[(4-methoxyphenyl)imino-N]ethyl}phenyl-C)(1,2,3,4,5-pentamethylcyclopentadienyl)iridium(III)
Molecular Weight	618.2
Molecular Formula	C26H32ClIrNO2
Canonical SMILES	C[C]1[C]([C]([C]([C]1C)C)C)C.CC(C1=[C-]C=C(C=C1)OC)[N-]C2=CC=C(C=C2)OC.Cl[Ir+2]
InChI	InChI=1S/C16H17NO2.C10H15.ClH.Ir/c1-12(13-4-8-15(18-2)9-5-13)17-14-6-10-16(19-3)11-7-14;1-6-7(2)9(4)10(5)8(6)3;/h4,6-12H,1-3H3;1-5H3;1H;/q-2;+3/p-1
InChI Key	PACNBAZCIOJTPD-UHFFFAOYSA-M
Purity	99%
Appearance	Orange powder
Complexity	460
Covalently-Bonded Unit Count	3
Defined Atom Stereocenter Count	0
Exact Mass	618.17508
Heavy Atom Count	31
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Monoisotopic Mass	618.17508
Rotatable Bond Count	3
Topological Polar Surface Area	19.5 Ų