Organofluorine / Alfa Chemistry
Copper, bis(2,9-dimethyl-1,10-phenanthroline-κN1,κN10)bis[μ-(1,1,1-trifluoromethanethiolato-κS:κS)]di-, stereoisomer

Copper, bis(2,9-dimethyl-1,10-phenanthroline-κN1,κN10)bis[μ-(1,1,1-trifluoromethanethiolato-κS:κS)]di-, stereoisomer

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Copper, bis(2,9-dimethyl-1,10-phenanthroline-κN1,κN10)bis[μ-(1,1,1-trifluoromethanethiolato-κS:κS)]di-, stereoisomer
Catalog OFC1450666019
CAS 1450666-01-9
Category Trifluoromethylthiolation Agents
Synonyms Stereoisomer of bis(2,9-dimethyl-1,10-phenanthroline-κN1,κN10)bis[μ-(1,1,1-trifluoromethanethiolato-κS:κS)]dicopper (ACI)
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Other Identifiers Chemical Data Computational Chemistry
InChI InChI=1S/2C14H12N2.2CF3S.2Cu/c2*1-9-3-5-11-7-8-12-6-4-10(2)16-14(12)13(11)15-9;2*2-1(3,4)5;;/h2*3-8H,1-2H3;;;;/q;;;;2*+2
InChI Key YCNXNVFHMKWTHA-UHFFFAOYSA-N
Canonical SMILES Cc1ccc2ccc3ccc(C)[n+]4c3c2[n+]1[Cu]41[SH](C(F)(F)F)[Cu]2([n+]3c(C)ccc4ccc5ccc(C)[n+]2c5c43)[SH]1C(F)(F)F
Molecular Formula C30H26Cu2F6N4S2+4
Molecular Weight 747.78
Exact Mass 746.0073

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