Geometry & MOs

Info

ID:	61870
PubChem CID:	26715150
Reduced:	SN3O6C22H29 (1)
Stoich.:	AB3C6D22E29 (1)
Weight, g/mol:	418.156243
ΔH_f, kcal/mol:	-218.5
Dipole, Da:	3.86
IP(EA), eV:	-8.75(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-acetylphenoxy)-N-[4-(propan-2-ylsulfamoyl)phenyl]butanamide

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)C(=O)NCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC(C)C)OCC

DOS

IR

Vibrations