IUPAC Name
(Z)-4-oxopent-2-en-2-olate;terbium(3+);hydrate
Molecular Weight
474.26g/mol
Molecular Formula
C15H23O7Tb
Canonical SMILES
CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].O.[Tb+3]
InChI
InChI=1S/3C5H8O2.H₂O.Tb/c3*1-4(6)3-5(2)7;;/h3*3,6H,1-2H3;1H2;/q;;;;+3/p-3/b3*4-3-;;
InChI Key
MRUSPMJZFLPYOU-KJVLTGTBSA-K
Complexity
90.4
Covalently-Bonded Unit Count
5
Exact Mass
474.06973g/mol
Formal Charge
0
H-Bond Acceptor
7
H-Bond Donor
1
Heavy Atom Count
23
Monoisotopic Mass
474.06973g/mol
Rotatable Bond Count
3
