Geometry & MOs

Info

ID:	35283
PubChem CID:	7979626
Reduced:	FSN2O4C19H19 (1)
Stoich.:	ABC2D4E19F19 (1)
Weight, g/mol:	409.086305
ΔH_f, kcal/mol:	-118.78
Dipole, Da:	2.3
IP(EA), eV:	-8.38(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[3-[4-(dimethylsulfamoyl)anilino]-3-oxopropyl]benzamide

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1OC)OC)C(=O)N/N=C\2/CCSC3=C2C=C(C=C3)F

DOS

IR

Vibrations