25517
  -OEChem-05062422442D

  6  4  0     0  0  0  0  0  0999 V2000
    0.2869    0.0000    0.0000 Cl  0  5  0  0  0  0  0  0  0  0  0  0
    0.5369    3.0369    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.0739    3.3469    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.7269    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2269    3.5739    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8469    2.5000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
M  CHG  2   1  -1   2   1
M  END
> <PUBCHEM_COMPOUND_CID>
25517

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
0

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
1

> <PUBCHEM_CACTVS_HBOND_DONOR>
1

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
0

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADcYACAAAEAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
ammonium;chloride

> <PUBCHEM_IUPAC_CAS_NAME>
ammonium;chloride

> <PUBCHEM_IUPAC_NAME_MARKUP>
azanium;chloride

> <PUBCHEM_IUPAC_NAME>
azanium;chloride

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
azanium;chloride

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
ammonium;chloride

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/ClH.H3N/h1H;1H3

> <PUBCHEM_IUPAC_INCHIKEY>
NLXLAEXVIDQMFP-UHFFFAOYSA-N

> <PUBCHEM_EXACT_MASS>
53.0032268

> <PUBCHEM_MOLECULAR_FORMULA>
ClH4N

> <PUBCHEM_MOLECULAR_WEIGHT>
53.49

> <PUBCHEM_REFERENCE_STANDARDIZATION>
Bypass - this structure was created from CID 25517

> <PUBCHEM_OPENEYE_CAN_SMILES>
[NH4+].[Cl-]

> <PUBCHEM_OPENEYE_ISO_SMILES>
[NH4+].[Cl-]

> <PUBCHEM_CACTVS_TPSA>
1

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
53.0032268

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
2

> <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>
2

> <PUBCHEM_CACTVS_TAUTO_COUNT>
-1

> <PUBCHEM_COORDINATE_TYPE>
1
5
255

$$$$