Geometry & MOs

Info

ID:	57944
PubChem CID:	24398003
Reduced:	SO2F3N4H17C22 (1)
Stoich.:	AB2C3D4E17F22 (1)
Weight, g/mol:	421.086305
ΔH_f, kcal/mol:	-139.31
Dipole, Da:	6.82
IP(EA), eV:	-8.68(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-acetamidophenyl)-4-chloro-3-pyrrolidin-1-ylsulfonylbenzamide

Drug info:

PubChemData

Smile

CC1=NN(C2=C1C=C(S2)C(=O)NC3=CC=CC(=C3)NC(=O)C)C4=CC=CC(=C4)C(F)(F)F

DOS

IR

Vibrations