Geometry & MOs

Info

ID:	287243
PubChem CID:	104234152
Reduced:	FN2O2C15H23 (1)
Stoich.:	AB2C2D15E23 (1)
Weight, g/mol:	341.02268
ΔH_f, kcal/mol:	-133.88
Dipole, Da:	3.54
IP(EA), eV:	-9.26(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[(3-bromo-4-fluorophenyl)methoxy]-3-fluorophenyl]ethanamine

Drug info:

PubChemData

Smile

CC(C)C(C)NC(=O)COC1=C(C=C(C=C1)C(C)N)F

DOS

IR

Vibrations