Geometry & MOs

Info

ID:	407442
PubChem CID:	135080107
Reduced:	BrNC17H18 (1)
Stoich.:	ABC17D18 (1)
Weight, g/mol:	319.03719
ΔH_f, kcal/mol:	57.94
Dipole, Da:	1.75
IP(EA), eV:	-8.57(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-2-bromo-3-fluoro-N-prop-2-enylaniline

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)N(CC=C)CC2=CC=CC=C2)Br

DOS

IR

Vibrations