Geometry & MOs

Info

ID:	197381
PubChem CID:	78960150
Reduced:	NOF3C12H16 (1)
Stoich.:	ABC3D12E16 (1)
Weight, g/mol:	319.05718
ΔH_f, kcal/mol:	-184.45
Dipole, Da:	5.48
IP(EA), eV:	-10.1(0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-[5-bromo-2-(1-phenylethoxy)phenyl]ethanamine

Drug info:

PubChemData

Smile

C#CCCNC(=O)C1CCCC(C1)C(F)(F)F

DOS

IR

Vibrations