Geometry & MOs

Info

ID:	290290
PubChem CID:	104426445
Reduced:	N3O3C14H21 (1)
Stoich.:	A3B3C14D21 (1)
Weight, g/mol:	298.135114
ΔH_f, kcal/mol:	-117.86
Dipole, Da:	4.81
IP(EA), eV:	-9.13(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methylpropyl)-3-(2-methylsulfonylanilino)propanamide

Drug info:

PubChemData

Smile

CC(C)CNC(=O)CCNC1=CC(=NC=C1)C(=O)OC

DOS

IR

Vibrations