Geometry & MOs

Info

ID:	284058
PubChem CID:	104031880
Reduced:	N2F4H10C13 (1)
Stoich.:	A2B4C10D13 (1)
Weight, g/mol:	236.078348
ΔH_f, kcal/mol:	-152.0
Dipole, Da:	5.81
IP(EA), eV:	-9.27(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-ethylthiophen-2-yl)methyl]-2-fluoropyridin-4-amine

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)CNC2=CC(=NC=C2)F)C(F)(F)F

DOS

IR

Vibrations