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tricalcium bis(chloranyl)methoxy-[oxidanyl(phosphonato)methyl]phosphinate

tricalcium bis(chloranyl)methoxy-[oxidanyl(phosphonato)methyl]phosphinate

Systemtic Name:tricalcium bis(chloranyl)methoxy-[oxidanyl(phosphonato)methyl]phosphinate
Openeye Name:tricalcium dichloromethoxy-[hydroxy(phosphonato)methyl]phosphinate
CAS Name:tricalcium dichloromethoxy-[hydroxy(phosphonato)methyl]phosphinate
IUPAC Name:tricalcium dichloromethoxy-[hydroxy(phosphonato)methyl]phosphinate
Traditional Name:tricalcium dichloromethoxy-[hydroxy(phosphonato)methyl]phosphinate
Formula: C4H6Ca3Cl4O14P4
MolecularWeight: 664.023084
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Descriptors Computed from Structure

Canonical SMILES:

C(O)(P(=O)([O-])[O-])P(=O)([O-])OC(Cl)Cl.C(O)(P(=O)([O-])[O-])P(=O)([O-])OC(Cl)Cl.[Ca+2].[Ca+2].[Ca+2]


Isomeric SMILES

C(O)(P(=O)([O-])[O-])P(=O)([O-])OC(Cl)Cl.C(O)(P(=O)([O-])[O-])P(=O)([O-])OC(Cl)Cl.[Ca+2].[Ca+2].[Ca+2]


InChI

InChI=1S/2C2H6Cl2O7P2.3Ca/c2*3-1(4)11-13(9,10)2(5)12(6,7)8;;;/h2*1-2,5H,(H,9,10)(H2,6,7,8);;;/q;;3*+2/p-6


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