Geometry & MOs

Info

ID:	427707
PubChem CID:	135161551
Reduced:	ON2C7H10 (1)
Stoich.:	AB2C7D10 (1)
Weight, g/mol:	315.155847
ΔH_f, kcal/mol:	1.6
Dipole, Da:	1.47
IP(EA), eV:	-8.22(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(4-ethylpiperazin-1-yl)-3-(trifluoromethyl)phenyl]acetamide

Drug info:

PubChemData

Smile

CN(C1=CC=CC=C1O)N

DOS

IR

Vibrations