Geometry & MOs

Info

ID:	263676
PubChem CID:	103388535
Reduced:	ClFN2O2C14H20 (1)
Stoich.:	ABC2D2E14F20 (1)
Weight, g/mol:	284.190006
ΔH_f, kcal/mol:	-160.51
Dipole, Da:	3.21
IP(EA), eV:	-8.64(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-5-methoxypentane-1,4-diamine

Drug info:

PubChemData

Smile

CC(CNC(=O)OC(C)(C)C)NC1=CC(=C(C=C1)Cl)F

DOS

IR

Vibrations