Geometry & MOs

Info

ID:	407521
PubChem CID:	135080267
Reduced:	NO4C11H17 (1)
Stoich.:	AB4C11D17 (1)
Weight, g/mol:	146.071822
ΔH_f, kcal/mol:	-136.84
Dipole, Da:	3.96
IP(EA), eV:	-9.33(0.62)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

3-(1H-pyrazol-5-yl)pyridin-1-ium

Drug info:

PubChemData

Smile

CC1(O[C@H]2CC3C(=CCON3[C@H]2O1)OC)C

DOS

IR

Vibrations