Geometry & MOs

Info

ID:	204953
PubChem CID:	80035828
Reduced:	SO2N3H11C14 (1)
Stoich.:	AB2C3D11E14 (1)
Weight, g/mol:	304.139862
ΔH_f, kcal/mol:	82.4
Dipole, Da:	9.16
IP(EA), eV:	-9.26(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-ethoxypropan-2-yl)-2-(methylamino)-5-(trifluoromethyl)benzamide

Drug info:

PubChemData

Smile

C1CN(CC2=C1SC=C2)C3=CC(=C(C=C3)C#N)[N+](=O)[O-]

DOS

IR

Vibrations