Geometry & MOs

Info

ID:	202928
PubChem CID:	79747261
Reduced:	BrFNC17H17 (1)
Stoich.:	ABCD17E17 (1)
Weight, g/mol:	374.95925
ΔH_f, kcal/mol:	19.27
Dipole, Da:	4.01
IP(EA), eV:	-9.27(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-bromo-4-fluorophenyl)-2-(3,4-dichlorophenyl)-N-methylethanamine

Drug info:

PubChemData

Smile

CNC(C1=CC(=C(C=C1)F)Br)C2(CC2)C3=CC=CC=C3

DOS

IR

Vibrations