(2,5-Dimethyl-1H-pyrrol-1-yl)(2,2'',4,4'',6,6''-hexamethyl[1,1':3',1''-terphenyl]-2'-olato)(2-methyl-2-phenylpropylidene)[2,3,4,5,6-pentafluorobenzenaminato(2-)-κN] ,(T-4) molybdenum(VI)

Catalog Number	ACM1433803792
CAS	1433803-79-2
Synonyms	2,6-Bis(2,4,6-trimethylphenyl)phenol;2,5-dimethylpyrrol-1-ide;(2-methyl-2-phenylpropylidene)-(2,3,4,5,6-pentafluorophenyl)iminomolybdenum
Molecular Weight	833.8
Molecular Formula	C46H46F5MoN2O
Canonical SMILES	CC1=CC=C([N-]1)C.CC1=CC(=C(C(=C1)C)C2=C(C(=CC=C2)C3=C(C=C(C=C3C)C)C)O)C.CC(C)(C=[Mo]=NC1=C(C(=C(C(=C1F)F)F)F)F)C2=CC=CC=C2
InChI	InChI=1S/C24H26O.C10H12.C6F5N.C6H8N.Mo/c1-14-10-16(3)22(17(4)11-14)20-8-7-9-21(24(20)25)23-18(5)12-15(2)13-19(23)6;1-10(2,3)9-7-5-4-6-8-9;7-1-2(8)4(10)6(12)5(11)3(1)9;1-5-3-4-6(2)7-5;/h7-13,25H,1-6H3;1,4-8H,2-3H3;3-4H,1-2H3;/q;-1;
InChI Key	WVJDOFZUINSQEI-UHFFFAOYSA-N
Appearance	Orange powder
Complexity	1130
Covalently-Bonded Unit Count	3
Defined Atom Stereocenter Count	0
Exact Mass	835.258434
Heavy Atom Count	55
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	1
Monoisotopic Mass	835.258434
Rotatable Bond Count	5
Topological Polar Surface Area	33.6 Ų