Geometry & MOs

Info

ID:	69834
PubChem CID:	47205501
Reduced:	SO3N4C11H12 (1)
Stoich.:	AB3C4D11E12 (1)
Weight, g/mol:	261.093583
ΔH_f, kcal/mol:	-28.96
Dipole, Da:	3.23
IP(EA), eV:	-9.46(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-imidazol-1-ylpropan-1-one

Drug info:

PubChemData

Smile

CC1=CC(=NO1)NC(=O)C(=O)NCC2=NC(=CS2)C

DOS

IR

Vibrations