Geometry & MOs

Info

ID:	55330
PubChem CID:	17390059
Reduced:	NOC3H5 (2)
Stoich.:	ABC3D5 (2)
Weight, g/mol:	255.077454
ΔH_f, kcal/mol:	-44.83
Dipole, Da:	4.74
IP(EA), eV:	-9.57(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-aminopropyl)-3-pyridin-4-yl-2H-1,2-oxazol-5-one;hydrochloride

Drug info:

PubChemData

Smile

CC1=C(C(=O)ON1)CCN

DOS

IR

Vibrations