3,4,5,6-tetrakis(chloranyl)phthalate; triphenylstannanylium

Systemtic Name: 3,4,5,6-tetrakis(chloranyl)phthalate; triphenylstannanylium Openeye Name: 3,4,5,6-tetrachlorophthalate; triphenylstannanylium CAS Name: 3,4,5,6-tetrachlorophthalate; triphenylstannanylium IUPAC Name: 3,4,5,6-tetrachlorophthalate; triphenylstannanylium Traditional Name: 3,4,5,6-tetrachlorophthalate; triphenylstannanylium Formula: C44H30Cl4O4Sn2 MolecularWeight: 1001.9386

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[Sn+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[Sn+](C2=CC=CC=C2)C3=CC=CC=C3.C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)[Sn+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[Sn+](C2=CC=CC=C2)C3=CC=CC=C3.C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C8H2Cl4O4.6C6H5.2Sn/c9-3-1(7(13)14)2(8(15)16)4(10)6(12)5(3)11;6*1-2-4-6-5-3-1;;/h(H,13,14)(H,15,16);6*1-5H;;/q;;;;;;;2*+1/p-2