Tris(6,6,7,7,8,8,8-heptafluoro-2,2-dimethyl-3,5-octanedionate)lanthanum(III)

• Catalog: OFC19106899
• CAS: 19106-89-9
• Category: Fluorinated Metal Complexes
• Synonyms: (1,1,1,2,2,3,3-Heptafluoro-7,7-Dimethyl-6-Oxoniumylideneoctan-4-Ylidene)Oxidanium;Lanthanum
• Purity: 98%
• MDL Number: MFCD00798418

• IUPAC Name: (Z)-6,6,7,7,8,8,8-heptafluoro-2,2-dimethyl-5-oxooct-3-en-3-olate;lanthanum(3+)
• InChI: InChI=1S/3C10H11F7O2.La/c3*1-7(2,3)5(18)4-6(19)8(11,12)9(13,14)10(15,16)17;/h3*4,18H,1-3H3;/q;;;+3/p-3/b3*5-4-
• InChI Key: JOMDRFHDFPOLDV-VNGPFPIXSA-K
• Isomeric SMILES: CC(/C(=C/C(=O)C(F)(F)C(F)(F)C(F)(F)F)/[O-])(C)C.CC(/C(=C/C(=O)C(F)(F)C(F)(F)C(F)(F)F)/[O-])(C)C.CC(/C(=C/C(=O)C(F)(F)C(F)(F)C(F)(F)F)/[O-])(C)C.[La+3]
• EC Number: 242-822-4

• Molecular Formula: C30H30F21LaO6
• Molecular Weight: 1024.44

• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 27
• Rotatable Bond Count: 12
• Exact Mass: 1024.077068 g/mol
• Monoisotopic Mass: 1024.077068 g/mol
• Topological Polar Surface Area: 120Ų
• Heavy Atom Count: 58
• Formal Charge: 0
• Complexity: 388