Geometry & MOs

Info

ID:	85652
PubChem CID:	49877880
Reduced:	BrClFON2H15C23 (1)
Stoich.:	ABCDE2F15G23 (1)
Weight, g/mol:	559.93965
ΔH_f, kcal/mol:	21.09
Dipole, Da:	3.44
IP(EA), eV:	-9.25(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-2-(4-bromophenyl)-5-[(2-fluorophenyl)methylidene]-3-(4-iodo-2-methylphenyl)imidazol-4-one

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1Cl)N2C(=N/C(=C\C3=CC=CC=C3F)/C2=O)C4=CC=C(C=C4)Br

DOS

IR

Vibrations