Geometry & MOs

Info

ID:	157866
PubChem CID:	56437644
Reduced:	SN3O6C19H29 (1)
Stoich.:	AB3C6D19E29 (1)
Weight, g/mol:	395.187878
ΔH_f, kcal/mol:	-246.63
Dipole, Da:	8.99
IP(EA), eV:	-8.71(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-[2-oxo-2-(3-piperidin-1-ylsulfonylanilino)ethyl]pentanamide

Drug info:

PubChemData

Smile

CC(C)CCC(=O)NCC(=O)NC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCOCC2

DOS

IR

Vibrations