Geometry & MOs

Info

ID:	260032
PubChem CID:	103179262
Reduced:	NSO4C11H17 (1)
Stoich.:	ABC4D11E17 (1)
Weight, g/mol:	267.183444
ΔH_f, kcal/mol:	-153.82
Dipole, Da:	2.76
IP(EA), eV:	-8.43(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-(3-methoxyphenyl)-N-[2-(3-methoxypropoxy)ethyl]ethanamine

Drug info:

PubChemData

Smile

COCCCOCCOC(=O)C1=C(C=CS1)N

DOS

IR

Vibrations