24247
 OpenBabel05082101102D

  6  5  0  0  0  0  0  0  0  0999 V2000
    2.8660    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.7320    0.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -0.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3660    0.8660    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3660   -0.8660    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2690    0.1900    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  2  0  0  0  0
  1  5  2  0  0  0  0
  2  6  1  0  0  0  0
M  END
>  <PUBCHEM_COMPOUND_CID>
24247

>  <PUBCHEM_COMPOUND_CANONICALIZED>
1

>  <PUBCHEM_CACTVS_COMPLEXITY>
114

>  <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
4

>  <PUBCHEM_CACTVS_HBOND_DONOR>
1

>  <PUBCHEM_CACTVS_ROTATABLE_BOND>
0

>  <PUBCHEM_CACTVS_SUBSKEYS>
AAADcQAAOAAEAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

>  <PUBCHEM_IUPAC_OPENEYE_NAME>
perchloric acid

>  <PUBCHEM_IUPAC_CAS_NAME>
perchloric acid

>  <PUBCHEM_IUPAC_NAME_MARKUP>
perchloric acid

>  <PUBCHEM_IUPAC_NAME>
perchloric acid

>  <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
perchloric acid

>  <PUBCHEM_IUPAC_TRADITIONAL_NAME>
perchloric acid

>  <PUBCHEM_IUPAC_INCHI>
InChI=1S/ClHO4/c2-1(3,4)5/h(H,2,3,4,5)

>  <PUBCHEM_IUPAC_INCHIKEY>
VLTRZXGMWDSKGL-UHFFFAOYSA-N

>  <PUBCHEM_XLOGP3_AA>
2.3

>  <PUBCHEM_EXACT_MASS>
99.956336

>  <PUBCHEM_MOLECULAR_FORMULA>
ClHO4

>  <PUBCHEM_MOLECULAR_WEIGHT>
100.46

>  <PUBCHEM_OPENEYE_CAN_SMILES>
OCl(=O)(=O)=O

>  <PUBCHEM_OPENEYE_ISO_SMILES>
OCl(=O)(=O)=O

>  <PUBCHEM_CACTVS_TPSA>
71.4

>  <PUBCHEM_MONOISOTOPIC_WEIGHT>
99.956336

>  <PUBCHEM_TOTAL_CHARGE>
0

>  <PUBCHEM_HEAVY_ATOM_COUNT>
5

>  <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

$$$$
