Geometry & MOs

Info

ID:	129474
PubChem CID:	51072733
Reduced:	Cl2N2O2C11H14 (1)
Stoich.:	A2B2C2D11E14 (1)
Weight, g/mol:	291.09047
ΔH_f, kcal/mol:	-89.85
Dipole, Da:	3.18
IP(EA), eV:	-8.93(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-phenylpropylsulfanyl)-N-(2,2,2-trifluoroethyl)acetamide

Drug info:

PubChemData

Smile

CC(COC)NC(=O)NC1=C(C=C(C=C1)Cl)Cl

DOS

IR

Vibrations