Geometry & MOs

Info

ID:	263771
PubChem CID:	103396890
Reduced:	FNO3C12H18 (1)
Stoich.:	ABC3D12E18 (1)
Weight, g/mol:	345.11036
ΔH_f, kcal/mol:	-153.92
Dipole, Da:	1.81
IP(EA), eV:	-9.01(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-bromo-4-fluoro-2-methoxyphenyl)-3-methyl-N-(2-methylpropyl)butan-1-amine

Drug info:

PubChemData

Smile

COCCNCC(C1=C(C=C(C=C1)OC)F)O

DOS

IR

Vibrations