Geometry & MOs

Info

ID:	277387
PubChem CID:	103828186
Reduced:	BrON3H10C14 (1)
Stoich.:	ABC3D10E14 (1)
Weight, g/mol:	286.092912
ΔH_f, kcal/mol:	49.25
Dipole, Da:	3.18
IP(EA), eV:	-9.84(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-cyanophenyl)-N-methyl-3-(2,2,2-trifluoroethoxy)propanamide

Drug info:

PubChemData

Smile

CN(C1=CC=C(C=C1)C#N)C(=O)C2=C(N=CC=C2)Br

DOS

IR

Vibrations