Geometry & MOs

Info

ID:	266867
PubChem CID:	103579816
Reduced:	FOCl2N2C13H17 (1)
Stoich.:	ABC2D2E13F17 (1)
Weight, g/mol:	317.994981
ΔH_f, kcal/mol:	-108.15
Dipole, Da:	4.6
IP(EA), eV:	-9.13(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,5-dichloro-4-fluoroanilino)-N-(2,2,2-trifluoroethyl)acetamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations