Geometry & MOs

Info

ID:	260060
PubChem CID:	103179484
Reduced:	NO3C13H29 (1)
Stoich.:	AB3C13D29 (1)
Weight, g/mol:	295.158372
ΔH_f, kcal/mol:	-155.26
Dipole, Da:	1.01
IP(EA), eV:	-8.77(2.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-fluoro-5-[2-(3-methoxypropoxy)ethoxymethyl]phenyl]prop-2-yn-1-amine

Drug info:

PubChemData

Smile

CCCCOCCCNCCOCCCOC

DOS

IR

Vibrations