Geometry & MOs

Info

ID:	120672
PubChem CID:	50739975
Reduced:	O2N3H9C11 (1)
Stoich.:	A2B3C9D11 (1)
Weight, g/mol:	180.089878
ΔH_f, kcal/mol:	18.95
Dipole, Da:	2.57
IP(EA), eV:	-9.74(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-oxido-N-propan-2-ylpyridin-1-ium-4-carboxamide

Drug info:

PubChemData

Smile

C1=CN=CC=C1NC(=O)C2=CC=[N+](C=C2)[O-]

DOS

IR

Vibrations