Geometry & MOs

Info

ID:	401073
PubChem CID:	135049976
Reduced:	SO4C18H24 (1)
Stoich.:	AB4C18D24 (1)
Weight, g/mol:	222.104952
ΔH_f, kcal/mol:	-153.5
Dipole, Da:	5.77
IP(EA), eV:	-9.92(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[(2E)-2-[chloro(phenyl)methylidene]butylidene]-dimethylazanium

Drug info:

PubChemData

Smile

CC(=O)CCC1(CCCCCCC1=O)S(=O)(=O)C2=CC=CC=C2

DOS

IR

Vibrations