Geometry & MOs

Info

ID:	296180
PubChem CID:	117559224
Reduced:	N2O3C12H18 (1)
Stoich.:	A2B3C12D18 (1)
Weight, g/mol:	230.121927
ΔH_f, kcal/mol:	-114.27
Dipole, Da:	2.83
IP(EA), eV:	-9.34(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-4-N-[(4-methylphenyl)methyl]benzene-1,4-diamine

Drug info:

PubChemData

Smile

COC(=O)CCC(CNCC1=CC=CC=N1)O

DOS

IR

Vibrations