Geometry & MOs

Info

ID:	266874
PubChem CID:	103579847
Reduced:	FNOCl2C10H12 (1)
Stoich.:	ABCD2E10F12 (1)
Weight, g/mol:	320.049461
ΔH_f, kcal/mol:	-107.09
Dipole, Da:	6.77
IP(EA), eV:	-8.7(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,5-dichloro-4-fluoroanilino)-1-morpholin-4-ylpropan-1-one

Drug info:

PubChemData

Smile

CC(C)(CNC1=CC(=C(C(=C1)Cl)F)Cl)O

DOS

IR

Vibrations