Geometry & MOs

Info

ID:	54868
PubChem CID:	17389446
Reduced:	SN2O4H22C23 (1)
Stoich.:	AB2C4D22E23 (1)
Weight, g/mol:	542.04304
ΔH_f, kcal/mol:	-2.3
Dipole, Da:	9.11
IP(EA), eV:	-9.1(-2.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(4-chlorophenyl)-1-(2-methylphenyl)imidazol-2-yl]sulfanyl-1-(4-ethoxyphenyl)ethanone;hydrobromide

Drug info:

PubChemData

Smile

CC[N+]1=CC=C(C=C1)C2=NC=C(O2)C3=CC=CC=C3.CC1=CC=C(C=C1)S(=O)(=O)[O-]

DOS

IR

Vibrations