diethyl(phenyl)azanium; tetrakis[2,3,4,5,6-pentakis(fluoranyl)phenyl]alumanuide

Systemtic Name: diethyl(phenyl)azanium; tetrakis[2,3,4,5,6-pentakis(fluoranyl)phenyl]alumanuide Openeye Name: diethyl(phenyl)ammonium; tetrakis(2,3,4,5,6-pentafluorophenyl)alumanuide CAS Name: diethyl(phenyl)ammonium; tetrakis(2,3,4,5,6-pentafluorophenyl)alumanuide IUPAC Name: diethyl(phenyl)azanium; tetrakis(2,3,4,5,6-pentafluorophenyl)alumanuide Traditional Name: diethyl(phenyl)ammonium; tetrakis(2,3,4,5,6-pentafluorophenyl)alumanuide Formula: C54H48AlF20N3+2 MolecularWeight: 1145.928622

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C1=CC=CC=C1.CC[NH+](CC)C1=CC=CC=C1.CC[NH+](CC)C1=CC=CC=C1.C1(=C(C(=C(C(=C1F)F)[Al-](C2=C(C(=C(C(=C2F)F)F)F)F)(C3=C(C(=C(C(=C3F)F)F)F)F)C4=C(C(=C(C(=C4F)F)F)F)F)F)F)F

Isomeric SMILES

CC[NH+](CC)C1=CC=CC=C1.CC[NH+](CC)C1=CC=CC=C1.CC[NH+](CC)C1=CC=CC=C1.C1(=C(C(=C(C(=C1F)F)[Al-](C2=C(C(=C(C(=C2F)F)F)F)F)(C3=C(C(=C(C(=C3F)F)F)F)F)C4=C(C(=C(C(=C4F)F)F)F)F)F)F)F

InChI

InChI=1S/3C10H15N.4C6F5.Al/c3*1-3-11(4-2)10-8-6-5-7-9-10;4*7-2-1-3(8)5(10)6(11)4(2)9;/h3*5-9H,3-4H2,1-2H3;;;;;/q;;;;;;;-1/p+3