Geometry & MOs

Info

ID:	202699
PubChem CID:	79710677
Reduced:	FNBr2H10C13 (1)
Stoich.:	ABC2D10E13 (1)
Weight, g/mol:	307.03719
ΔH_f, kcal/mol:	1.35
Dipole, Da:	2.35
IP(EA), eV:	-8.65(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-bromo-5-fluorophenyl)methyl]-3,5-dimethylaniline

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)NCC2=CC(=CC(=C2)Br)F)Br

DOS

IR

Vibrations