Geometry & MOs

Info

ID:	19753
PubChem CID:	571959
Reduced:	NO2C11H15 (1)
Stoich.:	AB2C11D15 (1)
Weight, g/mol:	193.110279
ΔH_f, kcal/mol:	-18.36
Dipole, Da:	3.13
IP(EA), eV:	-9.09(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,3-dimethyloxiran-2-yl)-5-ethyl-1-oxidopyridin-1-ium

Drug info:

PubChemData

Smile

CCC1=C[N+](=C(C=C1)C2C(O2)(C)C)[O-]

DOS

IR

Vibrations