Geometry & MOs

Info

ID:	192286
PubChem CID:	78253073
Reduced:	SN2O3C14H16 (1)
Stoich.:	AB2C3D14E16 (1)
Weight, g/mol:	326.108899
ΔH_f, kcal/mol:	-95.52
Dipole, Da:	7.76
IP(EA), eV:	-8.76(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-benzyl-1-(4-methoxyphenyl)-2-methylsulfanyl-4H-imidazol-5-one

Drug info:

PubChemData

Smile

CC1CCC2C(C1)C(=O)C(=CO2)C=C3C(=O)NC(=S)N3

DOS

IR

Vibrations