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Details

Stereochemistry ACHIRAL
Molecular Formula 2Al.2Ca.3O.O4Si
Molecular Weight 274.2
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CALCIUM ALUMINOSILICATE (CA2AL2SIO7)

SMILES

[O--].[O--].[O--].[Al+3].[Al+3].[Ca++].[Ca++].[O-][Si]([O-])([O-])[O-]

InChI

InChIKey=WMWJKESBRPVNQB-UHFFFAOYSA-N
InChI=1S/2Al.2Ca.O4Si.3O/c;;;;1-5(2,3)4;;;/q2*+3;2*+2;-4;3*-2

HIDE SMILES / InChI

Molecular Formula O4Si
Molecular Weight 92.0831
Charge -4
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 Al
Molecular Weight 26.9815
Charge 3
Count
MOL RATIO 2 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula HO
Molecular Weight 17.0073
Charge -1
Count
MOL RATIO 3 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula Ca
Molecular Weight 40.078
Charge 2
Count
MOL RATIO 2 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
V20H6W39QI
Record Status Validated (UNII)
Record Version