1,3-Bis(2,6-diisopropylphenyl)imidazol-2-ylidene(1,4-naphthoquinone)palladium(0) dimer

Catalog Number	ACM649736754-2
CAS	649736-75-4
Structure
Synonyms	[1,3-Bis[2,6-di(propan-2-yl)phenyl]imidazol-2-ylidene]palladium;naphthalene-1,4-dione
Molecular Weight	1306.3
Molecular Formula	C74H84N4O4Pd2
Canonical SMILES	CC(C)C1=C(C(=CC=C1)C(C)C)N2C=CN(C2=[Pd])C3=C(C=CC=C3C(C)C)C(C)C.CC(C)C1=C(C(=CC=C1)C(C)C)N2C=CN(C2=[Pd])C3=C(C=CC=C3C(C)C)C(C)C.C1=CC=C2C(=O)C=CC(=O)C2=C1.C1=CC=C2C(=O)C=CC(=O)C2=C1
InChI	InChI=1S/2C27H36N2.2C10H6O2.2Pd/c2*1-18(2)22-11-9-12-23(19(3)4)26(22)28-15-16-29(17-28)27-24(20(5)6)13-10-14-25(27)21(7)8;2*11-9-5-6-10(12)8-4-2-1-3-7(8)9;/h2*9-16,18-21H,1-8H3;2*1-6H;
InChI Key	POVDYDCNTKFAKJ-UHFFFAOYSA-N
Melting Point	>300 °C
Purity	96%
Appearance	Solid
Exact Mass	1306.45663
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	0
Monoisotopic Mass	1304.45622
Rotatable Bond Count	12
Topological Polar Surface Area	81.2 Ų