Geometry & MOs

Info

ID:	320432
PubChem CID:	126660919
Reduced:	NO4C11H15 (1)
Stoich.:	AB4C11D15 (1)
Weight, g/mol:	394.146347
ΔH_f, kcal/mol:	-73.7
Dipole, Da:	2.42
IP(EA), eV:	-9.25(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[5-methyl-4-oxo-2-(piperidin-4-ylidenemethyl)thieno[3,2-c]pyridin-7-yl]pyridin-2-yl]acetamide

Drug info:

PubChemData

Smile

C1COCCC1COC2=CC(=CN=C2)OO

DOS

IR

Vibrations