Geometry & MOs

Info

ID:	258555
PubChem CID:	103154937
Reduced:	N3O3C14H17 (1)
Stoich.:	A3B3C14D17 (1)
Weight, g/mol:	280.178693
ΔH_f, kcal/mol:	-73.08
Dipole, Da:	4.14
IP(EA), eV:	-8.96(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-3-methoxy-N-(2-methyl-4-propan-2-yloxyphenyl)butanamide

Drug info:

PubChemData

Smile

COC(CC(=O)NC1=CC=CC(=C1)C2=CN=CO2)CN

DOS

IR

Vibrations