Geometry & MOs

Info

ID:	287199
PubChem CID:	104233974
Reduced:	FNO3C13H18 (1)
Stoich.:	ABC3D13E18 (1)
Weight, g/mol:	273.152892
ΔH_f, kcal/mol:	-168.33
Dipole, Da:	2.75
IP(EA), eV:	-9.09(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[(2,6-dimethylphenyl)methoxy]-3-fluorophenyl]ethanamine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations