dioxidanium; ditert-butyl-(4-ditert-butylgallanyloxyphenoxy)gallane; ditert-butylgallium; dihydrate

Systemtic Name: dioxidanium; ditert-butyl-(4-ditert-butylgallanyloxyphenoxy)gallane; ditert-butylgallium; dihydrate Openeye Name: dioxonium; ditert-butyl-(4-ditert-butylgallanyloxyphenoxy)gallane; ditert-butylgallium; dihydrate CAS Name: dioxonium; ditert-butyl-(4-ditert-butylgallanyloxyphenoxy)gallane; ditert-butylgallium; dihydrate IUPAC Name: dioxidanium; ditert-butyl-(4-ditert-butylgallanyloxyphenoxy)gallane; ditert-butylgallium; dihydrate Traditional Name: dioxonium; ditert-butyl-(4-ditert-butylgallanyloxyphenoxy)gallane; ditert-butylgallium; dihydrate Formula: C38H86Ga4O6+2 MolecularWeight: 917.97784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[Ga]C(C)(C)C.CC(C)(C)[Ga]C(C)(C)C.CC(C)(C)[Ga](C(C)(C)C)OC1=CC=C(C=C1)O[Ga](C(C)(C)C)C(C)(C)C.[OH3+].[OH3+].O.O

Isomeric SMILES

CC(C)(C)[Ga]C(C)(C)C.CC(C)(C)[Ga]C(C)(C)C.CC(C)(C)[Ga](C(C)(C)C)OC1=CC=C(C=C1)O[Ga](C(C)(C)C)C(C)(C)C.[OH3+].[OH3+].O.O

InChI

InChI=1S/C6H6O2.8C4H9.4Ga.4H2O/c7-5-1-2-6(8)4-3-5;8*1-4(2)3;;;;;;;;/h1-4,7-8H;8*1-3H3;;;;;4*1H2/q;;;;;;;;;;;2*+1;;;;