Geometry & MOs

Info

ID:	202700
PubChem CID:	79710678
Reduced:	BrFNC15H15 (1)
Stoich.:	ABCD15E15 (1)
Weight, g/mol:	307.03719
ΔH_f, kcal/mol:	-18.7
Dipole, Da:	1.91
IP(EA), eV:	-8.43(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-bromo-5-fluorophenyl)methyl]-2,3-dimethylaniline

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)NCC2=CC(=CC(=C2)Br)F)C

DOS

IR

Vibrations