[1,3-Bis(ethoxycarbonyl)-2,4,5-trimethylcyclopentadien-1-yl]rhodium(III) dichloride dimer

Catalog Number	ACM1352745186
CAS	1352745-18-6
Synonyms	Dichloro[1,3-bis(ethoxycarbonyl)-2,4,5-trimethylcyclopentadienyl]rhodium(III) dimer
Molecular Weight	850.22
Molecular Formula	C28H38Cl4O8Rh2
Canonical SMILES	CCOC(=O)C1=C(C(=C([O-])OCC)C(=C1C)C)C.CCOC(=O)C1=C(C(=C([O-])OCC)C(=C1C)C)C.Cl[Rh+]Cl.Cl[Rh+]Cl
InChI	InChI=1S/2C14H20O4.4ClH.2Rh/c2*1-6-17-13(15)11-8(3)9(4)12(10(11)5)14(16)18-7-2;/h2*15H,6-7H2,1-5H3;4*1H;/q;2*+3/p-6/b2*13-11+;
InChI Key	FHZVVOKESDWYRG-NKSZVTFCSA-H
Purity	95%+
Appearance	Light yellow to amber to dark green powder to crystal
Complexity	417
Covalently-Bonded Unit Count	4
Defined Atom Stereocenter Count	0
Exact Mass	849.94012
Heavy Atom Count	42
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	0
Isomeric SMILES	CCOC(=O)C1=C(/C(=C(/OCC)\[O-])/C(=C1C)C)C.CCOC(=O)C1=C(/C(=C(/OCC)\[O-])/C(=C1C)C)C.Cl[Rh+]Cl.Cl[Rh+]Cl
Monoisotopic Mass	847.94307
Rotatable Bond Count	10
Topological Polar Surface Area	117 Ų