Geometry & MOs

Info

ID:	182680
PubChem CID:	76923044
Reduced:	Cl2N3C8H9 (1)
Stoich.:	A2B3C8D9 (1)
Weight, g/mol:	267.104148
ΔH_f, kcal/mol:	31.5
Dipole, Da:	1.91
IP(EA), eV:	-8.53(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-hydroxy-2-methyl-3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-3-oxopropanimidamide

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)Cl)CC(=NN)N)Cl

DOS

IR

Vibrations