Geometry & MOs

Info

ID:	382355
PubChem CID:	134973447
Reduced:	N2O7C29H30 (1)
Stoich.:	A2B7C29D30 (1)
Weight, g/mol:	290.99943
ΔH_f, kcal/mol:	-177.24
Dipole, Da:	2.64
IP(EA), eV:	-9.57(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

N-ethyl-6-iodo-1-methylpyridin-1-ium-3-carboxamide

Drug info:

PubChemData

Smile

C1[C@](C(=O)N1OCC2=CC=CC=C2)(CC[C@@H](C(=O)OCC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4)O

DOS

IR

Vibrations