Geometry & MOs

Info

ID:	277876
PubChem CID:	103831484
Reduced:	N3O3C14H21 (1)
Stoich.:	A3B3C14D21 (1)
Weight, g/mol:	281.173942
ΔH_f, kcal/mol:	-57.93
Dipole, Da:	7.58
IP(EA), eV:	-9.15(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-[1-(2-methoxyethyl)-6-oxopyridin-3-yl]hexanamide

Drug info:

PubChemData

Smile

CCCC[C@@H](C(=O)NC1=CC(=C(C=C1)CC)[N+](=O)[O-])N

DOS

IR

Vibrations