Geometry & MOs

Info

ID:	199111
PubChem CID:	79199892
Reduced:	NO2C6H8 (2)
Stoich.:	AB2C6D8 (2)
Weight, g/mol:	254.126657
ΔH_f, kcal/mol:	-94.78
Dipole, Da:	8.27
IP(EA), eV:	-9.46(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-hydroxy-N-[6-(2-methoxyethoxy)pyridin-3-yl]butanamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CCCCO

DOS

IR

Vibrations