Geometry & MOs

Info

ID:	211771
PubChem CID:	81053876
Reduced:	OSN3C11H13 (1)
Stoich.:	ABC3D11E13 (1)
Weight, g/mol:	278.174276
ΔH_f, kcal/mol:	-21.34
Dipole, Da:	2.13
IP(EA), eV:	-8.22(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-hydroxy-4-[3-(hydroxymethyl)piperidin-1-yl]-2,6-dimethylpyridine-3-carboximidamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C(=N1)C)C(=C(S2)C(=O)NC)N

DOS

IR

Vibrations