Geometry & MOs

Info

ID:	137199
PubChem CID:	52167926
Reduced:	O2N4C17H22 (1)
Stoich.:	A2B4C17D22 (1)
Weight, g/mol:	377.104542
ΔH_f, kcal/mol:	-47.15
Dipole, Da:	1.81
IP(EA), eV:	-8.22(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-1-[3-(methanesulfonamido)phenyl]ethyl]-3-methyl-2-nitrobenzamide

Drug info:

PubChemData

Smile

CC(C)N1C(=O)C(=NN(C1=O)C(C)C)N2CCC3=CC=CC=C32

DOS

IR

Vibrations