Geometry & MOs

Info

ID:	129628
PubChem CID:	51073365
Reduced:	ClO2N4C16H17 (1)
Stoich.:	AB2C4D16E17 (1)
Weight, g/mol:	306.03829
ΔH_f, kcal/mol:	-5.4
Dipole, Da:	3.9
IP(EA), eV:	-9.68(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-chloro-4-cyanophenoxy)-N-(2,2,2-trifluoroethyl)propanamide

Drug info:

PubChemData

Smile

CC(C)N1C(=CC=N1)NC(=O)C(C)OC2=C(C=C(C=C2)C#N)Cl

DOS

IR

Vibrations