Geometry & MOs

Info

ID:	422494
PubChem CID:	135117926
Reduced:	N4O5C19H20 (1)
Stoich.:	A4B5C19D20 (1)
Weight, g/mol:	351.125277
ΔH_f, kcal/mol:	-133.02
Dipole, Da:	3.45
IP(EA), eV:	-9.46(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxyethyl)-N-[(2-methyl-1H-imidazol-5-yl)methyl]-2-(4-methylsulfonylphenyl)acetamide

Drug info:

PubChemData

Smile

CC1=NOC(=C1)C[C@@H]2CN(C[C@H]2O)C(=O)C3=CC=C(C=C3)N4CC(=O)NC4=O

DOS

IR

Vibrations