Geometry & MOs

Info

ID:	287266
PubChem CID:	104234202
Reduced:	FN2O2C14H19 (1)
Stoich.:	AB2C2D14E19 (1)
Weight, g/mol:	295.169605
ΔH_f, kcal/mol:	-102.62
Dipole, Da:	6.15
IP(EA), eV:	-9.04(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(1-aminoethyl)-2-fluorophenoxy]-1-(4-methylpiperazin-1-yl)ethanone

Drug info:

PubChemData

Smile

CC(C1=CC(=C(C=C1)OC2CCCCNC2=O)F)N

DOS

IR

Vibrations