Geometry & MOs

Info

ID:	129755
PubChem CID:	51073726
Reduced:	SO3N4C14H18 (1)
Stoich.:	AB3C4D14E18 (1)
Weight, g/mol:	291.075157
ΔH_f, kcal/mol:	-34.49
Dipole, Da:	4.91
IP(EA), eV:	-9.2(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN(C)C(=O)CN(C)C(=O)CCC1=NC(=NO1)C2=CSC=C2

DOS

IR

Vibrations