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Details

Stereochemistry ACHIRAL
Molecular Formula 2CNS.Ba.3H2O
Molecular Weight 307.538
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BARIUM THIOCYANATE TRIHYDRATE

SMILES

O.O.O.[Ba++].[S-]C#N.[S-]C#N

InChI

InChIKey=USVMWHWKIBOLMH-UHFFFAOYSA-L
InChI=1S/2CHNS.Ba.3H2O/c2*2-1-3;;;;/h2*3H;;3*1H2/q;;+2;;;/p-2

HIDE SMILES / InChI

Molecular Formula Ba
Molecular Weight 137.327
Charge 2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula CNS
Molecular Weight 58.082
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula H2O
Molecular Weight 18.0153
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 22:28:59 GMT 2025
Edited
by admin
on Mon Mar 31 22:28:59 GMT 2025
Record UNII
T65E3UHC08
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BARIUM THIOCYANATE TRIHYDRATE [MI]
Preferred Name English
BARIUM THIOCYANATE TRIHYDRATE
MI  
Systematic Name English
THIOCYANIC ACID, BARIUM SALT, TRIHYDRATE
Systematic Name English
Code System Code Type Description
PUBCHEM
25021285
Created by admin on Mon Mar 31 22:28:59 GMT 2025 , Edited by admin on Mon Mar 31 22:28:59 GMT 2025
PRIMARY
FDA UNII
T65E3UHC08
Created by admin on Mon Mar 31 22:28:59 GMT 2025 , Edited by admin on Mon Mar 31 22:28:59 GMT 2025
PRIMARY
MERCK INDEX
m2264
Created by admin on Mon Mar 31 22:28:59 GMT 2025 , Edited by admin on Mon Mar 31 22:28:59 GMT 2025
PRIMARY Merck Index
CAS
68016-36-4
Created by admin on Mon Mar 31 22:28:59 GMT 2025 , Edited by admin on Mon Mar 31 22:28:59 GMT 2025
PRIMARY
Related Record Type Details
ANHYDROUS->SOLVATE