Tris(1,3-diphenyl-1,3-propanedionato)(1,10-phenanthroline)europium(III)

Catalog Number	ACM17904835-5
CAS	17904-83-5
Structure
Synonyms	Tris(dibenzoylmethane)phenanthroline europium(III)
Molecular Weight	1001.91
Molecular Formula	C57H41EuN2O6
Canonical SMILES	C1=CC=C(C=C1)/C(=C\C(=O)C2=CC=CC=C2)/O.C1=CC=C(C=C1)/C(=C\C(=O)C2=CC=CC=C2)/O.C1=CC=C(C=C1)/C(=C\C(=O)C2=CC=CC=C2)/O.C1=CC2=C(N=C1)C3=C(C=C2)C=CC=N3.[Eu]
InChI	InChI=1S/3C15H12O2.C12H8N2.Eu/c3*16-14(12-7-3-1-4-8-12)11-15(17)13-9-5-2-6-10-13;1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;/h3*1-11,16H;1-8H;/b3*14-11+;
InChI Key	DYKOLWWJTALFFU-RWBKAWJDSA-N
Melting Point	185-191 °C
Purity	95%+
Appearance	solid
Complexity	1180
Covalently-Bonded Unit Count	5
Defined Atom Stereocenter Count	0
Exact Mass	1005.24117
Heavy Atom Count	66
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	3
Isomeric SMILES	C1=CC=C(C=C1)/C(=C\C(=O)C2=CC=CC=C2)/O.C1=CC=C(C=C1)/C(=C\C(=O)C2=CC=CC=C2)/O.C1=CC=C(C=C1)/C(=C\C(=O)C2=CC=CC=C2)/O.C1=CC2=C(N=C1)C3=C(C=C2)C=CC=N3.[Eu]
Monoisotopic Mass	1005.24117
Rotatable Bond Count	9
Topological Polar Surface Area	138 Ų