Geometry & MOs

Info

ID:	139118
PubChem CID:	52475858
Reduced:	OSN5H19C26 (1)
Stoich.:	ABC5D19E26 (1)
Weight, g/mol:	399.140533
ΔH_f, kcal/mol:	103.75
Dipole, Da:	3.05
IP(EA), eV:	-7.96(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-N-(4-methylphenyl)-2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetamide

Drug info:

PubChemData

Smile

CC1=NC2=CC=CC=C2C3=C(C4=CC=CC=C4N13)NC(=O)CC5=CSC(=N5)C6=CN=CC=C6

DOS

IR

Vibrations