Geometry & MOs

Info

ID:	272162
PubChem CID:	103729896
Reduced:	SN2C18H20 (1)
Stoich.:	AB2C18D20 (1)
Weight, g/mol:	306.07712
ΔH_f, kcal/mol:	56.91
Dipole, Da:	1.24
IP(EA), eV:	-8.92(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-chloro-5-methylpyridin-3-yl)-2,5-dimethoxybenzamide

Drug info:

PubChemData

Smile

CCC1=CN=C(S1)CNC(C)C2=CC3=CC=CC=C3C=C2

DOS

IR

Vibrations