Geometry & MOs

Info

ID:	125957
PubChem CID:	50945607
Reduced:	O3N5C20H25 (1)
Stoich.:	A3B5C20D25 (1)
Weight, g/mol:	431.187878
ΔH_f, kcal/mol:	-66.25
Dipole, Da:	2.79
IP(EA), eV:	-8.62(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-methoxy-N-(4-methylphenyl)sulfonylanilino)-N-(1-methylpiperidin-4-yl)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)NCCNC(=O)C2=CC3=C(C=C2)OCO3)N4CCCCC4

DOS

IR

Vibrations