Geometry & MOs

Info

ID:	298580
PubChem CID:	117651308
Reduced:	FON3C13H16 (1)
Stoich.:	ABC3D13E16 (1)
Weight, g/mol:	468.012504
ΔH_f, kcal/mol:	-45.07
Dipole, Da:	3.6
IP(EA), eV:	-9.01(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-4-[5-chloro-6-(2-fluoro-2-methylpropoxy)pyridin-3-yl]oxy-2-fluoro-N-methylsulfonylbenzamide

Drug info:

PubChemData

Smile

CC(CNC1=CC(=C(C=C1)C(=O)N(C)C)F)C#N

DOS

IR

Vibrations