Geometry & MOs

Info

ID:	258526
PubChem CID:	103154720
Reduced:	N3O3C13H17 (1)
Stoich.:	A3B3C13D17 (1)
Weight, g/mol:	290.199428
ΔH_f, kcal/mol:	-74.84
Dipole, Da:	6.04
IP(EA), eV:	-8.92(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-3-methoxy-N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]butanamide

Drug info:

PubChemData

Smile

COC(CC(=O)NC1=CC(=CC=C1)OCC#N)CN

DOS

IR

Vibrations