Catalog Number
ACM17904835-5
Product Name
Tris(1,3-diphenyl-1,3-propanedionato)(1,10-phenanthroline)europium(III)
Category
Organic Light-Emitting Diode (OLED) Materials
Synonyms
Tris(dibenzoylmethane)phenanthroline europium(III)
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
Covalently-Bonded Unit Count
5
Defined Atom Stereocenter Count
0
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
Topological Polar Surface Area
138 Ų