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Details

Stereochemistry ACHIRAL
Molecular Formula 3C2O4.Fe.3H2O.3H4N
Molecular Weight 428.063
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Ferric ammonium oxalate trihydrate

SMILES

[NH4+].[NH4+].[NH4+].O.O.O.[Fe+3].[O-]C(=O)C([O-])=O.[O-]C(=O)C([O-])=O.[O-]C(=O)C([O-])=O

InChI

InChIKey=LVWHKVQBJNDDEL-UHFFFAOYSA-K
InChI=1S/3C2H2O4.Fe.3H3N.3H2O/c3*3-1(4)2(5)6;;;;;;;/h3*(H,3,4)(H,5,6);;3*1H3;3*1H2/q;;;+3;;;;;;/p-3

HIDE SMILES / InChI

Molecular Formula Fe
Molecular Weight 55.845
Charge 3
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C2O4
Molecular Weight 88.019
Charge -2
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

Molecular Formula H4N
Molecular Weight 18.0385
Charge 1
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 Sat Dec 16 20:17:04 UTC 2023
Edited
by admin
on Sat Dec 16 20:17:04 UTC 2023
Record UNII
YQ3KT5HG9F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Ferric ammonium oxalate trihydrate
Common Name English
Ammonium iron oxalate, (NH<sub>4</sub>)<sub>3</sub>Fe(C<sub>2</sub>O<sub>4</sub>)<sub>3</sub>, trihydrate
Systematic Name English
Ethanedioic acid, ammonium iron(3+) salt, hydrate (3:3:1:3)
Systematic Name English
Ammonium iron(III) oxalate trihydrate
Common Name English
Code System Code Type Description
CAS
13268-42-3
Created by admin on Sat Dec 16 20:17:04 UTC 2023 , Edited by admin on Sat Dec 16 20:17:04 UTC 2023
PRIMARY
PUBCHEM
159471543
Created by admin on Sat Dec 16 20:17:04 UTC 2023 , Edited by admin on Sat Dec 16 20:17:04 UTC 2023
PRIMARY
FDA UNII
YQ3KT5HG9F
Created by admin on Sat Dec 16 20:17:04 UTC 2023 , Edited by admin on Sat Dec 16 20:17:04 UTC 2023
PRIMARY
Related Record Type Details
ANHYDROUS->SOLVATE