Geometry & MOs

Info

ID:	290036
PubChem CID:	104400740
Reduced:	SO2N3C10H19 (1)
Stoich.:	AB2C3D10E19 (1)
Weight, g/mol:	308.140389
ΔH_f, kcal/mol:	-83.28
Dipole, Da:	3.97
IP(EA), eV:	-9.12(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-2-[2-(chloromethyl)-6-methylimidazo[4,5-b]pyridin-3-yl]propanamide

Drug info:

PubChemData

Smile

CC1CN=C(S1)NC(C)C(=O)NCCOC

DOS

IR

Vibrations