14455607
  -OEChem-05072417372D

 43 39  0     0  0  0  0  0  0999 V2000
    5.4641    0.6900    0.0000 Eu  0  1  0  0  0  0  0  0  0  0  0  0
    6.3301    1.1900    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    5.4641   -0.3100    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    4.5981    1.1900    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    7.1962    2.6900    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3301   -1.8100    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    1.1900    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0622    1.1900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981   -1.8100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320    2.6900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1962    0.6900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981   -0.8100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    2.1900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0622    2.1900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641   -2.3100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    2.1900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1962   -0.3100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320   -0.3100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641    2.6900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9282    2.6900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641   -3.3100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    2.6900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5991    0.8800    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0611   -2.1200    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320    3.3100    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5762   -0.3100    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1962   -0.9300    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.8162   -0.3100    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0420    0.2269    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1951   -0.0000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4220   -0.8469    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7741    2.1531    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0010    3.0000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1541    3.2269    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.2382    2.1531    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4651    3.0000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.6182    3.2269    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8441   -3.3100    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641   -3.9300    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0841   -3.3100    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3100    3.2269    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4631    3.0000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6900    2.1531    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  2 11  1  0  0  0  0
  3 12  1  0  0  0  0
  4 13  1  0  0  0  0
  5 14  2  0  0  0  0
  6 15  2  0  0  0  0
  7 16  2  0  0  0  0
  8 11  2  0  0  0  0
  8 14  1  0  0  0  0
  8 23  1  0  0  0  0
  9 12  2  0  0  0  0
  9 15  1  0  0  0  0
  9 24  1  0  0  0  0
 10 13  2  0  0  0  0
 10 16  1  0  0  0  0
 10 25  1  0  0  0  0
 11 17  1  0  0  0  0
 12 18  1  0  0  0  0
 13 19  1  0  0  0  0
 14 20  1  0  0  0  0
 15 21  1  0  0  0  0
 16 22  1  0  0  0  0
 17 26  1  0  0  0  0
 17 27  1  0  0  0  0
 17 28  1  0  0  0  0
 18 29  1  0  0  0  0
 18 30  1  0  0  0  0
 18 31  1  0  0  0  0
 19 32  1  0  0  0  0
 19 33  1  0  0  0  0
 19 34  1  0  0  0  0
 20 35  1  0  0  0  0
 20 36  1  0  0  0  0
 20 37  1  0  0  0  0
 21 38  1  0  0  0  0
 21 39  1  0  0  0  0
 21 40  1  0  0  0  0
 22 41  1  0  0  0  0
 22 42  1  0  0  0  0
 22 43  1  0  0  0  0
M  CHG  4   1   3   2  -1   3  -1   4  -1
M  END
> <PUBCHEM_COMPOUND_CID>
14455607

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
90.4

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
6

> <PUBCHEM_CACTVS_HBOND_DONOR>
0

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
3

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADceBwOAAAAAAAAAAAAABAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGgAAAAAACASAgAACAAAAAACIAKBSAAAAAAAgIAAACAAAAEgAAAAAAQAAAAAAAAAIAQIAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
europium(3+);(Z)-4-oxopent-2-en-2-olate

> <PUBCHEM_IUPAC_CAS_NAME>
europium(3+);(Z)-4-oxo-2-penten-2-olate

> <PUBCHEM_IUPAC_NAME_MARKUP>
europium(3+);(<I>Z</I>)-4-oxopent-2-en-2-olate

> <PUBCHEM_IUPAC_NAME>
europium(3+);(Z)-4-oxopent-2-en-2-olate

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
europium(3+);(Z)-4-oxidanylidenepent-2-en-2-olate

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
europium(3+);(Z)-4-ketopent-2-en-2-olate

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/3C5H8O2.Eu/c3*1-4(6)3-5(2)7;/h3*3,6H,1-2H3;/q;;;+3/p-3/b3*4-3-;

> <PUBCHEM_IUPAC_INCHIKEY>
AKYVEELUVDHHLT-LNTINUHCSA-K

> <PUBCHEM_EXACT_MASS>
450.05505

> <PUBCHEM_MOLECULAR_FORMULA>
C15H21EuO6

> <PUBCHEM_MOLECULAR_WEIGHT>
449.29

> <PUBCHEM_OPENEYE_CAN_SMILES>
CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].[Eu+3]

> <PUBCHEM_OPENEYE_ISO_SMILES>
C/C(=C/C(=O)C)/[O-].C/C(=C/C(=O)C)/[O-].C/C(=C/C(=O)C)/[O-].[Eu+3]

> <PUBCHEM_CACTVS_TPSA>
120

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
450.05505

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
22

> <PUBCHEM_ATOM_DEF_STEREO_COUNT>
0

> <PUBCHEM_ATOM_UDEF_STEREO_COUNT>
0

> <PUBCHEM_BOND_DEF_STEREO_COUNT>
3

> <PUBCHEM_BOND_UDEF_STEREO_COUNT>
0

> <PUBCHEM_ISOTOPIC_ATOM_COUNT>
0

> <PUBCHEM_COMPONENT_COUNT>
4

> <PUBCHEM_CACTVS_TAUTO_COUNT>
-1

> <PUBCHEM_COORDINATE_TYPE>
1
5
255

$$$$