ditert-butyltin(1+); tris(fluoranyl)methanesulfonate; tetrahydrate

Systemtic Name: ditert-butyltin(1+); tris(fluoranyl)methanesulfonate; tetrahydrate Openeye Name: ditert-butyltin(1+); trifluoromethanesulfonate; tetrahydrate CAS Name: ditert-butyltin(1+); trifluoromethanesulfonate; tetrahydrate IUPAC Name: ditert-butyltin(1+); trifluoromethanesulfonate; tetrahydrate Traditional Name: ditert-butyltin(1+) ditriflate tetrahydrate Formula: C18H44F6O10S2Sn2 MolecularWeight: 836.076379

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[Sn+]C(C)(C)C.CC(C)(C)[Sn+]C(C)(C)C.C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].O.O.O.O

Isomeric SMILES

CC(C)(C)[Sn+]C(C)(C)C.CC(C)(C)[Sn+]C(C)(C)C.C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].O.O.O.O

InChI

InChI=1S/4C4H9.2CHF3O3S.4H2O.2Sn/c4*1-4(2)3;2*2-1(3,4)8(5,6)7;;;;;;/h4*1-3H3;2*(H,5,6,7);4*1H2;;/q;;;;;;;;;;2*+1/p-2