Geometry & MOs

Info

ID:	202639
PubChem CID:	79702696
Reduced:	BrFNO2C15H21 (1)
Stoich.:	ABCD2E15F21 (1)
Weight, g/mol:	325.02777
ΔH_f, kcal/mol:	-128.13
Dipole, Da:	4.49
IP(EA), eV:	-8.81(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-bromo-5-fluorophenyl)-1-(3-fluorophenyl)-N-methylethanamine

Drug info:

PubChemData

Smile

CCCN1CCOC(C1)C(CC2=CC(=CC(=C2)Br)F)O

DOS

IR

Vibrations