Geometry & MOs

Info

ID:	258530
PubChem CID:	103154746
Reduced:	O3N4C14H20 (1)
Stoich.:	A3B4C14D20 (1)
Weight, g/mol:	293.173942
ΔH_f, kcal/mol:	-105.89
Dipole, Da:	7.64
IP(EA), eV:	-8.22(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-3-methoxy-N-[3-(2-methylpropanoylamino)phenyl]butanamide

Drug info:

PubChemData

Smile

COC(CC(=O)NC1=CC=C(C=C1)N2CCNC2=O)CN

DOS

IR

Vibrations