Geometry & MOs

Info

ID:	120769
PubChem CID:	50743923
Reduced:	FOSN2H17C20 (1)
Stoich.:	ABCD2E17F20 (1)
Weight, g/mol:	372.069927
ΔH_f, kcal/mol:	4.85
Dipole, Da:	1.96
IP(EA), eV:	-9.0(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(4-chlorophenyl)-2,2-dimethyl-5-sulfanylideneimidazol-1-yl]-(4-methoxyphenyl)methanone

Drug info:

PubChemData

Smile

C1CCC2(C1)N=C(C(=S)N2C(=O)C3=CC=CC=C3)C4=CC=C(C=C4)F

DOS

IR

Vibrations