Geometry & MOs

Info

ID:	258492
PubChem CID:	103154468
Reduced:	ClO2N3C13H20 (1)
Stoich.:	AB2C3D13E20 (1)
Weight, g/mol:	252.147393
ΔH_f, kcal/mol:	-70.59
Dipole, Da:	4.89
IP(EA), eV:	-8.46(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN(C)C1=C(C=CC=C1Cl)NC(=O)CC(CN)OC

DOS

IR

Vibrations