Geometry & MOs

Info

ID:	155997
PubChem CID:	56368669
Reduced:	ON4C24H34 (1)
Stoich.:	AB4C24D34 (1)
Weight, g/mol:	438.193691
ΔH_f, kcal/mol:	-18.35
Dipole, Da:	3.43
IP(EA), eV:	-8.67(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(4-methylphenyl)acetyl]-N-(2-morpholin-4-ylsulfonylethyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=NN1CC2=CC(=CC=C2)C(=O)NC3CCN(C3)C4CCCCCC4)C

DOS

IR

Vibrations