Geometry & MOs

Info

ID:	56661
PubChem CID:	17505318
Reduced:	N2O3C23H24 (1)
Stoich.:	A2B3C23D24 (1)
Weight, g/mol:	359.056233
ΔH_f, kcal/mol:	-52.24
Dipole, Da:	6.4
IP(EA), eV:	-8.46(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-fluorophenyl)-N-(3-methylsulfanylphenyl)-2-sulfanylidene-1H-imidazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(N1CC2=CC=CO2)C)/C=C/C(=O)NC3CCOC4=CC=CC=C34

DOS

IR

Vibrations