Geometry & MOs

Info

ID:	269928
PubChem CID:	103619921
Reduced:	IN2O2C11H13 (1)
Stoich.:	AB2C2D11E13 (1)
Weight, g/mol:	237.111341
ΔH_f, kcal/mol:	42.05
Dipole, Da:	10.36
IP(EA), eV:	-9.13(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 6-[(2-amino-2-oxoethyl)-methylamino]pyridine-3-carboxylate

Drug info:

PubChemData

Smile

CC1CC1CNC2=CC(=C(C=C2)[N+](=O)[O-])I

DOS

IR

Vibrations