Geometry & MOs

Info

ID:	287192
PubChem CID:	104233951
Reduced:	FON3C13H16 (1)
Stoich.:	ABC3D13E16 (1)
Weight, g/mol:	290.106671
ΔH_f, kcal/mol:	-37.49
Dipole, Da:	3.54
IP(EA), eV:	-9.04(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-fluoro-4-[(4-nitrophenyl)methoxy]phenyl]ethanamine

Drug info:

PubChemData

Smile

CC(C1=CC(=C(C=C1)OCC2=NC=CN2C)F)N

DOS

IR

Vibrations