Geometry & MOs

Info

ID:	56110
PubChem CID:	17404498
Reduced:	SO3N6C24H24 (1)
Stoich.:	AB3C6D24E24 (1)
Weight, g/mol:	369.131112
ΔH_f, kcal/mol:	22.52
Dipole, Da:	6.65
IP(EA), eV:	-9.1(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)sulfanyl]-N-[(2-fluorophenyl)methyl]acetamide

Drug info:

PubChemData

Smile

CCC1(C(=O)N(C(=O)N1)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4CC4)C5=CC=CC=C5

DOS

IR

Vibrations