Geometry & MOs

Info

ID:	263839
PubChem CID:	103401163
Reduced:	NSO3C14H25 (1)
Stoich.:	ABC3D14E25 (1)
Weight, g/mol:	257.142722
ΔH_f, kcal/mol:	-117.3
Dipole, Da:	1.5
IP(EA), eV:	-8.89(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-fluoro-4-[3-(2-methoxyethoxy)propoxymethyl]aniline

Drug info:

PubChemData

Smile

CC1=C(SC=C1)C(C(C)N)OCCCOCCOC

DOS

IR

Vibrations