Geometry & MOs

Info

ID:	284057
PubChem CID:	104031066
Reduced:	ClFNOH11C13 (1)
Stoich.:	ABCDE11F13 (1)
Weight, g/mol:	270.078011
ΔH_f, kcal/mol:	-52.05
Dipole, Da:	3.99
IP(EA), eV:	-9.41(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-N-[[2-(trifluoromethyl)phenyl]methyl]pyridin-4-amine

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1Cl)C)OC2=CC(=NC=C2)F

DOS

IR

Vibrations