Geometry & MOs

Info

ID:	55432
PubChem CID:	17395392
Reduced:	ClSN2O3C15H19 (1)
Stoich.:	ABC2D3E15F19 (1)
Weight, g/mol:	246.136828
ΔH_f, kcal/mol:	-94.44
Dipole, Da:	4.04
IP(EA), eV:	-9.2(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-cyanophenoxy)-N-(2-methylpropyl)propanamide

Drug info:

PubChemData

Smile

CC1CC1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=CC=C3)Cl

DOS

IR

Vibrations