Geometry & MOs

Info

ID:	198945
PubChem CID:	79176374
Reduced:	SN4C11H12 (1)
Stoich.:	AB4C11D12 (1)
Weight, g/mol:	299.98719
ΔH_f, kcal/mol:	62.32
Dipole, Da:	6.79
IP(EA), eV:	-8.55(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(4-iodopyrazol-1-yl)-4-methylpyridin-3-amine

Drug info:

PubChemData

Smile

CC1=NC(=NC=C1)SC2=NC=C(C(=C2)C)N

DOS

IR

Vibrations