16683095
  -OEChem-05102422302D

  8  7  0     0  0  0  0  0  0999 V2000
    6.3301    0.2500    0.0000 Bi  0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    0.2500    0.0000 Bi  0  0  0  0  0  0  0  0  0  0  0  0
    5.4641    0.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320    0.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981   -0.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1962    0.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    0.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  1  0  0  0  0
  1  6  2  0  0  0  0
  2  4  1  0  0  0  0
  2  7  2  0  0  0  0
  3  8  1  0  0  0  0
  4  8  1  0  0  0  0
  5  8  2  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_CID>
16683095

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
97

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
5

> <PUBCHEM_CACTVS_HBOND_DONOR>
0

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
2

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADcQAAOAAAAAAAAAAAACAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAgAAAAAAAAAAAAAACAAAAAAIAAAACAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
bis(oxobismuthanyl) carbonate

> <PUBCHEM_IUPAC_CAS_NAME>
carbonic acid bis(oxobismuthinyl) ester

> <PUBCHEM_IUPAC_NAME_MARKUP>
bis(oxobismuthanyl) carbonate

> <PUBCHEM_IUPAC_NAME>
bis(oxobismuthanyl) carbonate

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
bis(oxidanylidenebismuthanyl) carbonate

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
carbonic acid bis(ketobismuthinyl) ester

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/CH2O3.2Bi.2O/c2-1(3)4;;;;/h(H2,2,3,4);;;;/q;2*+1;;/p-2

> <PUBCHEM_IUPAC_INCHIKEY>
MGLUJXPJRXTKJM-UHFFFAOYSA-L

> <PUBCHEM_EXACT_MASS>
509.93537

> <PUBCHEM_MOLECULAR_FORMULA>
CBi2O5

> <PUBCHEM_MOLECULAR_WEIGHT>
509.97

> <PUBCHEM_OPENEYE_CAN_SMILES>
C(=O)(O[Bi]=O)O[Bi]=O

> <PUBCHEM_OPENEYE_ISO_SMILES>
C(=O)(O[Bi]=O)O[Bi]=O

> <PUBCHEM_CACTVS_TPSA>
69.7

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
509.93537

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
8

> <PUBCHEM_ATOM_DEF_STEREO_COUNT>
0

> <PUBCHEM_ATOM_UDEF_STEREO_COUNT>
0

> <PUBCHEM_BOND_DEF_STEREO_COUNT>
0

> <PUBCHEM_BOND_UDEF_STEREO_COUNT>
0

> <PUBCHEM_ISOTOPIC_ATOM_COUNT>
0

> <PUBCHEM_COMPONENT_COUNT>
1

> <PUBCHEM_CACTVS_TAUTO_COUNT>
1

> <PUBCHEM_COORDINATE_TYPE>
1
5
255

$$$$