decacalcium tetrakis(oxidanidyl)-oxidanyl-$l^{5}-phosphane tetraphosphate

Systemtic Name: decacalcium tetrakis(oxidanidyl)-oxidanyl-$l^{5}-phosphane tetraphosphate Openeye Name: decacalcium hydroxy(tetraoxido)-$l^{5}-phosphane tetraphosphate CAS Name: decacalcium hydroxy(tetraoxido)phosphorane tetraphosphate IUPAC Name: decacalcium hydroxy(tetraoxido)-$l^{5}-phosphane tetraphosphate Traditional Name: decacalcium hydroxy(tetraoxido)phosphorane tetraphosphate Formula: Ca10H2O26P6 MolecularWeight: 1004.622846

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Descriptors Computed from Structure

Canonical SMILES:

OP([O-])([O-])([O-])[O-].OP([O-])([O-])([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2]

Isomeric SMILES

OP([O-])([O-])([O-])[O-].OP([O-])([O-])([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2]

InChI

InChI=1S/10Ca.2HO5P.4H3O4P/c;;;;;;;;;;2*1-6(2,3,4)5;4*1-5(2,3)4/h;;;;;;;;;;2*1H;4*(H3,1,2,3,4)/q10*+2;2*-4;;;;/p-12