Geometry & MOs

Info

ID:	258719
PubChem CID:	103156592
Reduced:	N2O3C12H18 (1)
Stoich.:	A2B3C12D18 (1)
Weight, g/mol:	261.168856
ΔH_f, kcal/mol:	-119.83
Dipole, Da:	3.93
IP(EA), eV:	-8.78(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-3-methoxy-N-[3-(2-methoxyethylamino)-3-oxopropyl]butanamide

Drug info:

PubChemData

Smile

COC(CC(=O)NC1=CC=C(C=C1)CO)CN

DOS

IR

Vibrations