Tris(1,10-phenanthroline)cobalt(III) trichloride pentahydrate

Catalog Number	ACM15406834
CAS	15406-83-4
Synonyms	Cobalt(3+);1,10-phenanthroline;trichloride;pentahydrate
Molecular Weight	795.99
Molecular Formula	C36H34Cl3CoN6O5
Canonical SMILES	C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.O.O.O.O.O.[Cl-].[Cl-].[Cl-].[Co+3]
InChI	InChI=1S/3C12H8N2.3ClH.Co.5H2O/c3*1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;/h3*1-8H;3*1H;5*1H2/q;+3;/p-3
InChI Key	HBKKJECUBQVSOC-UHFFFAOYSA-K
Purity	97%
Complexity	183
Covalently-Bonded Unit Count	12
Defined Atom Stereocenter Count	0
Exact Mass	794.09882
Heavy Atom Count	51
Hydrogen Bond Acceptor Count	14
Hydrogen Bond Donor Count	5
Monoisotopic Mass	794.09882
Rotatable Bond Count	0
Topological Polar Surface Area	82.3 Ų