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Details

Stereochemistry ACHIRAL
Molecular Formula C8H4AuN2O2S.Na
Molecular Weight 412.151
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TRIPHAL

SMILES

[Na+].[O-]C(=O)C1=C2N=C(NC2=CC=C1)S[Au]

InChI

InChIKey=BLDRFDUOUJXWGC-UHFFFAOYSA-L
InChI=1S/C8H6N2O2S.Au.Na/c11-7(12)4-2-1-3-5-6(4)10-8(13)9-5;;/h1-3H,(H,11,12)(H2,9,10,13);;/q;2*+1/p-2

HIDE SMILES / InChI

Molecular Formula C8H4AuN2O2S
Molecular Weight 389.161
Charge -1
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula Na
Molecular Weight 22.98976928
Charge 1
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
3X5C0Z836X
Record Status Validated (UNII)
Record Version