Geometry & MOs

Info

ID:	206968
PubChem CID:	80326793
Reduced:	ClNSC18H24 (1)
Stoich.:	ABCD18E24 (1)
Weight, g/mol:	289.122655
ΔH_f, kcal/mol:	-3.68
Dipole, Da:	1.96
IP(EA), eV:	-9.14(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(6-ethoxypyridin-3-yl)amino]methyl]-4-fluorobenzamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CC(CC2=NC(=CS2)C(C)(C)C)CCl

DOS

IR

Vibrations