Geometry & MOs

Info

ID:	199478
PubChem CID:	79253197
Reduced:	SN3O3C13H17 (1)
Stoich.:	AB3C3D13E17 (1)
Weight, g/mol:	247.168462
ΔH_f, kcal/mol:	-101.46
Dipole, Da:	3.03
IP(EA), eV:	-9.32(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-2-[(2-methylimidazo[1,2-a]pyridin-3-yl)methylamino]butan-1-ol

Drug info:

PubChemData

Smile

CC(C)C(CO)NC(=O)CN1C=NC2=C(C1=O)C=CS2

DOS

IR

Vibrations