Geometry & MOs

Info

ID:	38944
PubChem CID:	8138209
Reduced:	N3O3C16H19 (1)
Stoich.:	A3B3C16D19 (1)
Weight, g/mol:	390.124943
ΔH_f, kcal/mol:	-71.3
Dipole, Da:	1.2
IP(EA), eV:	-8.86(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)OCCCC(=O)NNC(=O)C2=CC=CN2

DOS

IR

Vibrations