Chloro[(1,3-dimesitylimidazol-2-ylidene)(N,N-dimethylbenzylamine)palladium(II)]

Catalog Number	ACM1058661781-1
CAS	1058661-78-1
Structure
Synonyms	[1,3-Bis(2,4,6-trimethylphenyl)imidazol-2-ylidene]palladium;N,N-dimethyl-1-phenylmethanamine;chloride
IUPAC Name	[1,3-bis(2,4,6-trimethylphenyl)imidazol-2-ylidene]palladium;N,N-dimethyl-1-phenylmethanamine;chloride
Molecular Weight	580.5
Molecular Formula	C30H36ClN3Pd
Canonical SMILES	CC1=CC(=C(C(=C1)C)N2C=CN(C2=[Pd])C3=C(C=C(C=C3C)C)C)C.CN(C)CC1=CC=CC=[C-]1.[Cl-]
InChI	InChI=1S/C21H24N2.C9H12N.ClH.Pd/c1-14-9-16(3)20(17(4)10-14)22-7-8-23(13-22)21-18(5)11-15(2)12-19(21)6;1-10(2)8-9-6-4-3-5-7-9;/h7-12H,1-6H3;3-6H,8H2,1-2H3;1H;/q;-1;/p-1
InChI Key	DGPOQJVFBKBRDT-UHFFFAOYSA-M
Melting Point	225-230 °C
Purity	98%+
Appearance	Powder
Exact Mass	579.16326
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Monoisotopic Mass	579.16326
Rotatable Bond Count	4
Topological Polar Surface Area	9.7 Ų