2,5-Cyclohexadiene-1,4-dione, 2,5-dichloro-3,6-dihydroxy-, lanthanum(3+) salt (3:2)

Catalog Number	ACM32607231-2
CAS	32607-23-1
Structure
Synonyms	2,5-Dichloro-3,6-dioxocyclohexa-1,4-diene-1,4-diolate;lanthanum(3+)
Molecular Weight	898.7
Molecular Formula	C18Cl6La2O12
Canonical SMILES	C1(=C(C(=O)C(=C(C1=O)Cl)[O-])Cl)[O-].C1(=C(C(=O)C(=C(C1=O)Cl)[O-])Cl)[O-].C1(=C(C(=O)C(=C(C1=O)Cl)[O-])Cl)[O-].[La+3].[La+3]
InChI	InChI=1S/3C6H2Cl2O4.2La/c3*7-1-3(9)5(11)2(8)6(12)4(1)10;/h3*9,12H;/q;2*+3/p-6
InChI Key	XFCYTTPBGABCBW-UHFFFAOYSA-H
Purity	98%+
Complexity	275
Covalently-Bonded Unit Count	5
Defined Atom Stereocenter Count	0
Exact Mass	897.56187
Heavy Atom Count	38
Hydrogen Bond Acceptor Count	12
Hydrogen Bond Donor Count	0
Monoisotopic Mass	895.56482
Rotatable Bond Count	0
Topological Polar Surface Area	241 Ų