Geometry & MOs

Info

ID:	198139
PubChem CID:	79054785
Reduced:	ClFNH13C14 (1)
Stoich.:	ABCD13E14 (1)
Weight, g/mol:	219.105942
ΔH_f, kcal/mol:	-22.02
Dipole, Da:	3.54
IP(EA), eV:	-8.64(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-fluoro-5-methyl-N-[(5-methylfuran-2-yl)methyl]aniline

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)F)NCC2=CC=CC=C2Cl

DOS

IR

Vibrations