Geometry & MOs

Info

ID:	284574
PubChem CID:	104053327
Reduced:	FO2C17H17 (1)
Stoich.:	AB2C17D17 (1)
Weight, g/mol:	287.168543
ΔH_f, kcal/mol:	-95.77
Dipole, Da:	2.9
IP(EA), eV:	-8.71(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-fluoro-4-(4-methoxy-2,5-dimethylphenyl)phenyl]methyl]ethanamine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1OC)C)C2=C(C=CC(=C2)C(=O)C)F

DOS

IR

Vibrations