Geometry & MOs

Info

ID:	134264
PubChem CID:	51670987
Reduced:	NOC3H5 (2)
Stoich.:	ABC3D5 (2)
Weight, g/mol:	219.100777
ΔH_f, kcal/mol:	-37.82
Dipole, Da:	9.67
IP(EA), eV:	-8.58(1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-azaniumylpropyl)-3-pyridin-4-yl-1,2-oxazol-5-olate

Drug info:

PubChemData

Smile

CC1=NOC(=C1CC[NH3+])[O-]

DOS

IR

Vibrations