Geometry & MOs

Info

ID:	194259
PubChem CID:	78504545
Reduced:	NSO4C18H21 (1)
Stoich.:	ABC4D18E21 (1)
Weight, g/mol:	382.189257
ΔH_f, kcal/mol:	-135.76
Dipole, Da:	7.07
IP(EA), eV:	-9.68(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2-methylpiperidin-1-yl)-2-oxoethyl] 2-(4-anilinophenoxy)acetate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)S(=O)(=O)NCC(=O)OC(C)C2=CC=CC=C2)C

DOS

IR

Vibrations