Geometry & MOs

Info

ID:	38939
PubChem CID:	8138202
Reduced:	N3O3C20H25 (1)
Stoich.:	A3B3C20D25 (1)
Weight, g/mol:	418.156243
ΔH_f, kcal/mol:	-84.27
Dipole, Da:	4.6
IP(EA), eV:	-9.24(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1R)-2-(diethylamino)-2-oxo-1-phenylethyl] 2-[(4-methylphenyl)sulfonylamino]acetate

Drug info:

PubChemData

Smile

CCCCCC1=CC=C(C=C1)C(=O)CCC(=O)NNC(=O)C2=CC=CN2

DOS

IR

Vibrations