Geometry & MOs

Info

ID:	124703
PubChem CID:	50893219
Reduced:	NSCl3F3O3H9C15 (1)
Stoich.:	ABC3D3E3F9G15 (1)
Weight, g/mol:	374.989898
ΔH_f, kcal/mol:	-246.73
Dipole, Da:	2.71
IP(EA), eV:	-9.75(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[N-(benzenesulfonyl)-3-chloro-4-fluoroanilino]propanoyl chloride

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)N(CC(=O)Cl)S(=O)(=O)C2=CC(=C(C=C2)Cl)Cl)C(F)(F)F

DOS

IR

Vibrations