Geometry & MOs

Info

ID:	267691
PubChem CID:	103584974
Reduced:	N2F3H13C14 (1)
Stoich.:	A2B3C13D14 (1)
Weight, g/mol:	339.04342
ΔH_f, kcal/mol:	-96.97
Dipole, Da:	1.81
IP(EA), eV:	-8.52(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(3-bromophenyl)propyl]-2,5-difluoro-4-methylaniline

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1F)NC(C)C2=NC=C(C=C2)F)F

DOS

IR

Vibrations